Basic information
- CAS
1989-25-9- Standard SMILES
CC(C)(O)c1ccc(Cl)cc1- InChIKey
JQZCRSDZIWKYBF-UHFFFAOYSA-N- Molecular formula
- C9H11ClO
- Average molar mass
- 170.63 g/mol
- Monoisotopic mass
- 170.0498427
Names & identifiers
- Preferred name
- p-Chloro-alpha,alpha-dimethylbenzyl alcohol
- IUPAC
- 2-(4-chlorophenyl)propan-2-ol
- English name
- p-chloro-alpha,alpha-dimethylbenzyl alcohol
- Molecular formula
- C9H11ClO
- Molecular weight
- 170.64
Names & synonyms
1989-25-9p-Chloro-alpha,alpha-dimethylbenzyl alcoholEINECS 217-865-7DTXSID00173647RefChem:858018DTXCID6096138217-865-72-(4-chlorophenyl)propan-2-ol2-(4-Chlorophenyl)-2-propanolMFCD11870102Benzenemethanol, 4-chloro-alpha,alpha-dimethyl-SCHEMBL1016971
Show more names
p-chloro-±-cumyl alcohol2-(p-Chlorophenyl)-2-propanolα,α-Dimethyl-4-chlorobenzyl alcohol4-Chloro-α,α-dimethylbenzenemethanolBenzenemethanol, 4-chloro-α,α-dimethyl-4-Chloro-alpha,alpha-dimethylbenzyl Alcohol
SCHEMBL48022392-(4-chloro-phenyl)-propan-2-ol2-(4-Chlorophenyl)-2-propanol #BAA989254-Chloro-a,a-dimethylbenzenemethanolAKOS009996843SB84106AS-64058
Database identifiers
- CAS
1989-25-9- PubChem CID
- 74808
- DTXSID
DTXSID00173647- EC Number
- 217-865-7
- Nikkaji
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 126
Physicochemical properties
- Melting point
- 31 · 31-32 °C
- Boiling point
- 92 · 92-96 °C
- Density
- 1.144 · 1.144±0.06 g/cm3(Predicted)
- solubility
- soluble in Methanol
- form
- powder to lump
- pka
- 14.29 · 14.29±0.29(Predicted)
- color
- White to Orange to Green
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
- HS Code
- 2906290090 · 2906290090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2906290090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Applications
Usesp-chloro-alpha,alpha-dimethylbenzyl alcohol is primarily used as an intermediate in chemical synthesis.
Upstream & downstream products
Downstream products
Suppliers37 total
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
泰州葛林美克医药科技有限公司15366892466 · [email protected]
河南闰霖化工有限公司+86-18738066252; +86-18738066252 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
成都添福瑞生物科技有限公司18030648795 18030648795 · [email protected]
安庆融创生物科技有限公司15001988657 · [email protected]
天津林宸科技有限公司15122256084 15122256084 · [email protected]
Shanxi Tihondan Pharmaceutical Technology Co., Ltd+8618235132063 · [email protected]
常州康瑞医药科技有限公司+86-0519-85485169 +86-13961161173 · [email protected]
Related reactions
1 records
Compound notes
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