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Tris-(3-methoxy-phenyl)-methanol

HCID 4170779
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Basic information

CAS
114399-81-4
Standard SMILES
COc1cccc(C(O)(c2cccc(OC)c2)c2cccc(OC)c2)c1
InChIKey
RRKSSYISDKNBSG-UHFFFAOYSA-N
Molecular formula
C22H22O4
Average molar mass
350.4 g/mol
Monoisotopic mass
350.15180918

Names & identifiers

Preferred name
Tris-(3-methoxy-phenyl)-methanol
IUPAC
tris(3-methoxyphenyl)methanol
English name
tris(3-methoxyphenyl)methanol
Molecular formula
C22H22O4
Molecular weight
350.40768

Names & synonyms

TRIS-(3-METHOXY-PHENYL)-METHANOLRefChem:900412114399-81-4654-020-5AKOS024430271tris(3-methoxyphenyl)methanol

Database identifiers

CAS
114399-81-4
PubChem CID
4170779
EC Number
654-020-5

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
47.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
26
Formal charge
0
Complexity
367

Physicochemical properties

Symbol(GHS)
7 · GHS07,GHS05
Signal word
Danger
Hazard statements
315 · H315-H318-H335-H413
Precautionary statements
264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310

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

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS07,GHS05
Hazard statements
H315-H318-H335-H413
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310

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Compound notes

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