2-Propylphenol 2-丙基苯酚

CAS 644-35-9 MFCD00002251

化学结构图

644-35-9
SMILES: CCCc1ccccc1O

化学属性

Mol. FormulaC9H12O
Mol. Weight136.19
Refractive index1.5250 to 1.5290
Boiling Point214°C
Density0.989 g/mL at 25 °C(lit.)
Flash Point93°C(lit.)
TSCAYes

别名和识别编码

Chemical Name2-Propylphenol
Synonym ORTHO-PROPYLPHENOL {uni_hamburg} FEMA 3522 2-propyl-pheno Phenol, o-propyl- o-Propylphenol 2-Propyl-phenol 2-正丙基苯酚,97% Phenol,o-propyl- o-propyl-pheno 1-(2-Hydroxyphenyl)propan 2-n-Propylphenol,97% 邻正丙基苯酚 2-Propylphenol o-Propylphenol 2-N-PROPYLPHENOL 2-PROPYLHYDROXYBENZENE 1-Hydroxy-2-n-propylbenzene 2-PROPYLPHENOL 2-正丙基苯酚 Phenol, o-propyl- o-n-Propylphenol 2-PROPYLPHENOL 97+% Phenol, 2-propyl- 2-n-Propylphenol Phenol,2-propyl- o-propyl-phen O-N-PROPYLPHENOL 2-丙基苯酚 鄰丙[苯]酚
CAS Number644-35-9
PubChem Substance ID87574711
EC Number211-415-3
MDL NumberMFCD00002251
Reaxys-RN1363932
Beilstein Registry Number6,499
Alfabeta NamePROPYLPHENOL 2-
Chemical Name Translation2-丙基苯酚
InChIKeyLCHYEKKJCUJAKN-UHFFFAOYSA-N
Wiswesser Line NotationQR B3
LabNetwork Molecule IDLN00183083
InChIInChI=1S/C9H12O/c1-2-5-8-6-3-4-7-9(8)10/h3-4,6-7,10H,2,5H2,1H3
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分类

  • {SNA} Alphabetical Listings, Flavors and Fragrances, O-P
  • {SNA} Alphabetical Listings, Certified Food Grade Products, Flavors and Fragrances, Follows IFRA Guidelines, N-P, O-P
  • {SNA} Building Blocks, C9 to C20+, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds,

相关文献及参考

  • Beil. 6 ,499
  • Aldrich MSDS 1 , 1554:A / Corp MSDS 1 (2), 2969:C / FT-IR 1 (1), 1069:D / FT-IR 2 (2), 1836:D / FT-NMR 1 (2), 244:A / Fenaroli (703) / IR-Spectra (3), 644:D / IR-Spectra (2), 574:D / NMR-Reference 2 (1), 867:D / RegBook 1 (1), 1265:D / Sax 6 , 2313 / Structure Index 1 , 192:D:1 / Vapor Phase 3 , 1001:D
  • Short: IV/20B Title: Vapor Pressure and Antoine Coefficients for Oxygen Containing Organic Compounds Author: Dykyj, J.; Svoboda, J.; Wilhoit, R.C.; Frenkel, M.; Hall, K.R. Editor: Hall, K.R. Source: Landolt-Börnstein, New Series Volume: IV/20B Year: 2000 Keyword: organic compounds; vapor pressure ISBN: 3-540-64968-9 ISBN: 978-3-540-64968-7 Internet Resource: DOI:10.1007/b71424 RefComment: VII, 320 pages.
  • Short: IV/8I Title: Densities of Phenols, Aldehydes, Ketones, Carboxylic Acids, Amines, Nitriles, and Nitrohydrocarbons Author: Frenkel, M.; Hong, X.; Dong, Q.; Yan, X.; Chirico, R.D. Editor: Frenkel, M.; Marsh, K.N. Source: Landolt-Börnstein, New Series Volume: IV/8I Year: 2002 Keyword: Thermodynamics; Thermodynamik ISBN: 978-3-540-42883-1 ISBN: 3-540-42883-6 Internet Resource: DOI:10.1007/b76771 RefComment: XI, 470 p., Hardcover RefComment: Written for Scientists and engineers in the fields of Physics, Chemistry and Physical Chemistry Abstract: Critically evaluated experimental data covering the densities of organic compounds are essential for both scientific and industrial applications. Knowledge of densities is important in many areas, including custody transfer of materials, product specification, development of various predictive methods, and for characterizing compounds and estimating their purity.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.eur

安全信息

GHS Symbol
WGK Germany3
Hazard Codes Xn
Hazard statements
  • H227 Combustible liquid 可燃液体
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H332 Harmful if inhaled 吸入有害
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSSM8600000
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西,喝水或吸烟。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P301+P330+P331+P310
  • P303+P361+P353
  • P303+P361+P353+P310+P363
  • P304+P340
  • P304+P340+P310
  • P305+P351+P338+P310
  • P370+P378
  • P403+P235
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Warning {} {} {} {} {TCI}
UN Number 3145 UN 3145 8/PG 3 UN3145
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
  • R22 Harmful if swallowed 吞咽有害
  • R34 Causes burns 会导致灼伤
Safety Statements
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
  • S28 After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 皮肤接触后,立即用大量…(由生产厂家指定)冲洗;
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后,立即用大量水冲洗并征求医生意见;
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
Packing GroupIII
Warnings IRRITANT
Hazard Class8
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ETATAW Eesti NSV Teaduste Akadeemia Toimetised, Biologia.  Proceedings of
   the Academy of Sciences of the Estonian SSR.  (V/O Mezhdunarodnaya Kniga,
   113095 Moscow, USSR)  V.5-    1956-  Volume(issue)/page/year: 24,281,1975

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 356 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 39(7),94,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 450 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 39(7),94,1974

其他信息

  • 图谱信息:2-正丙基苯酚(644-35-9)质谱(MS) 2-正丙基苯酚(644-35-9)红外图谱(IR1) 2-正丙基苯酚(644-35-9)核磁图( 1 HNMR) 2-正丙基苯酚(644-35-9)核磁图( 13 CNMR) 2-正丙基苯酚(644-35-9)Raman光谱
  • 2-正丙基苯酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 P0530 2-丙基苯酚 2-Propylphenol 25ML 702元 2010/06/21 131610050 2-正丙基苯酚 2-n-Propylphenol 98% 5 GR 273元 2010/06/21 131610250 2-正丙基苯酚 2-n-Propylphenol 98% 25 GR 741元
  • FEMA:3522
  • TCI Shanghai:2-丙基苯酚 2-Propylphenol,>;98.0%(GC)(644-35-9)
  • Alfa Aesar:2-正丙基苯酚,97% 2-n-Propylphenol, 97%(644-35-9)
  • Acros Organics:2-正丙基苯酚 2-n-Propylphenol, 98%(644-35-9)
  • MOL 文件:644-35-9.mol
  • Sigma Aldrich:644-35-9(sigmaaldrich)

系列性分类


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