CAS 28150-13-2 (3,5-Diaminophenyl)methanol (HCID 586680)

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Basic information

CAS: 28150-13-2
Standard SMILES: Nc1cc(N)cc(CO)c1
InChIKey: OHLQBRYVKXJYHZ-UHFFFAOYSA-N
Molecular formula: C7H10N2O
Average molar mass: 138.17 g/mol

Names & identifiers

Preferred name: (3,5-Diaminophenyl)methanol
IUPAC: (3,5-diaminophenyl)methanol
English name: Benzenemethanol, 3,5-diamino-
Molecular formula: C7
Molecular weight: 138.17

Names & synonyms

(3,5-Diaminophenyl)methanol28150-13-2RefChem:399348891-856-13,5-Diaminobenzyl alcohol3,5-DiaminobenzylalcoholSCHEMBL205947(3,5-Diaminophenyl)methanol #AKOS006220950DB-289843CS-0380419EN300-6739265

Show more names

Benzenemethanol, 3,5-diamino-

Z1203578993

Database identifiers

CAS: 28150-13-2
PubChem CID: 586680
EC Number: 891-856-1
Nikkaji: J231.904G

Properties

Computed structural properties

XLogP: -0.3
Topological polar surface area: 72.3 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 97.8

Safety & regulation

GHS classification

GHS Classification · 4 items

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, P317, 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.