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Tris(4-chlorophenyl)methanol

HCID 76379
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3010-80-8
Standard SMILES
OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIKey
BPFKTJMHOWDJKI-UHFFFAOYSA-N
Molecular formula
C19H13Cl3O
Average molar mass
363.7 g/mol
Monoisotopic mass
362.003198

Overview

Tris(4-chlorophenyl)methanol is a triarylmethane that is tris(4-chlorophenyl)methane in which the hydrogen of the central carbon is replaced by a hydroxy group. It is a byproduct of DDT manufacturing and is a highly persistent contaminant found in the environment and which bio-accumulates in marine species. It has a role as a persistent organic pollutant. It is a tertiary alcohol, a triarylmethane and a member of monochlorobenzenes. It is functionally related to a tris(4-chlorophenyl)methane.

Names & identifiers

Preferred name
Tris(4-chlorophenyl)methanol
IUPAC
tris(4-chlorophenyl)methanol
English name
4,4',4''-TRICHLOROTRITYL ALCOHOL
Molecular formula
C19H13Cl3O
Molecular weight
363.66

Names & synonyms

Tris(4-chlorophenyl)methanol3010-80-8DTXSID50184187L8ST3Y4RMWTCPM compoundRefChem:192103DTXCID60106678221-137-44,4',4''-Trichlorotrityl alcoholC19H13Cl3Otriphenylcarbinol, 4,4',4''-trichloro-TCPMOH
Show more names
Tri(4-chlorophenyl)methanoltris(p-chlorophenyl)methanoltris(p-chlorophenyl) carbinolTRIS-(4-CHLOROPHENYL) METHANOL4-Chloro-α,α-bis(4-chlorophenyl)benzenemethanolOC(c(ccc(c1)Cl)c1)(c(ccc(c2)Cl)c2)c(ccc(c3)Cl)c3Benzenemethanol, 4-chloro-α,α-bis(4-chlorophenyl)-Tris(p-chlorophenyl) carbinol~Tris(p-chlorophenyl)methanol
EINECS 221-137-4MFCD00051795TCPMTRIS-(4-CHLORO-PHENYL)-METHANOLtris-(p-chlorophenyl) methanolSCHEMBL74345394-Chloro-alpha,alpha-bis(4-chlorophenyl)benzenemethanoltris(4-chlorophenyl)methan-1-ol

Database identifiers

CAS
3010-80-8

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
23
Formal charge
0
Complexity
310

Physicochemical properties

Melting point
96 · 96-97°C
storage temp.
2 · 2-8°C
BRN
2293156 · 2293156
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
RTECS
4160000 · PC4160000

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 · 4 items

Danger

H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationREACH registered substance: TCPM (EC: 434-220-7)
Hazard Classes and CategoriesAcute Tox. 4 (20%)

Safety data

rtecs
PC4160000
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
safety_code
26-36
Hazard statements
H315-H319-H335
Precautionary statements
P261-P280a-P304+P340-P305+P351+P338-P405-P501a

Chemistry & industry

Applications

UsesTris(4-chlorophenyl)methanol is a standard for environmental testing and research. Study on the effects of environmental poluutants/organochlorines on male fertility.

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Related reactions

4 records
New reaction record
HRID 566897 reaction equation
HRID 566897As reactantuspto-grants-2001_01
HRID 1004566 reaction equation
HRID 1004566As reactantuspto-grants-2000_04
HRID 1004568 reaction equation
HRID 1004568As reactantuspto-grants-2000_04
HRID 1227699 reaction equation
HRID 1227699As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
PubChem CID
76379
DTXSID
DTXSID50184187
ChEBI
CHEBI:231325
UNII
L8ST3Y4RMW
EC Number
221-137-4、434-220-7
Nikkaji
J205.309H