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3-(1-Methylethyl)-1,2-benzenediol

3-(1-Methylethyl)-1,2-benzenediol structure

CAS No:
2138-48-9
Formula:
C9H12O2
Chemical Name:
3-(1-Methylethyl)-1,2-benzenediol
Synonyms:
1,2-Benzenediol,3-(1-methylethyl)-;Pyrocatechol,3-isopropyl-;3-(1-Methylethyl)-1,2-benzenediol;3-Isopropylcatechol;3-Isopropylpyrocatechol;3-Isopropyl-1,2-dihydroxybenzene;1,2-Dihydroxy-3-isopropylbenzene;3-Isopropylbenzene-1,2-diol;NSC 62675;3-Propan-2-ylbenzene-1,2-diol

Description

ChEBI: A member of the class of catechols that is catechol in which one of the hydrogens that is ortho to a hydroxy group has been replaced by an isopropyl group.

3-isopropylcatechol is a member of the class of catechols that is catechol in which one of the hydrogens that is ortho to a hydroxy group has been replaced by an isopropyl group.

3-(1-Methylethyl)-1,2-benzenediol Basic Attributes

Molecular Weight：

152.193

Exact Mass：

152.19

EC Number：

218-385-0

UNII：

SOV0198261

NSC Number：

62675

DSSTox ID：

DTXSID80175644

HScode：

2907299090

Characteristics

PSA：

40.5

XLogP3：

2.3

Density：

1.1±0.1 g/cm3

Melting Point：

47.0 °C

Boiling Point：

155-156.5 °C @ Press: 30 Torr

Flash Point：

125.7±16.4 °C

Refractive Index：

1.562

Safety Information

Precautionary statement(s)：

P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P391, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:152.19
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:152.083729621
Monoisotopic Mass:152.083729621
Topological Polar Surface Area:40.5
Heavy Atom Count:11
Complexity:123
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 2 hexanone; diphosphorus pentoxide formula; ivorit; ethanol chemical formula; difenidol; triiodide

Guide of 3-(1-Methylethyl)-1,2-benzenediol

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties

3-(1-Methylethyl)-1,2-benzenediol

SDS

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