(3-Amino-4-methylphenyl)methanol (HCID 586243)

Names & identifiers

Preferred name: (3-Amino-4-methylphenyl)methanol
IUPAC: (3-amino-4-methylphenyl)methanol
English name: 3-Amino-4-methylbenzyl alcohol
Molecular formula: C8H11NO
Molecular weight: 137.18

Names & synonyms

(3-Amino-4-methylphenyl)methanol81863-45-8benzenemethanol, 3-amino-4-methyl-RefChem:399850628-925-0InChI=1/C8H11NO/c1-6-2-3-7(5-10)4-8(6)9/h2-4,10H,5,9H2,1H3-Amino-4-methylbenzyl alcoholMFCD000750513-amino-4-methylbenzylalcohol3-amino4-methylbenzyl alcoholSCHEMBL703673SCHEMBL4056677

Show more names

(3-Amino-4-methylphenyl)3-amino-4-methylphenmethylol3-AMino-4-Methylbenzyl alcohol 97%3-AMINO-4-METHYLBENZYL ALCOHOL USP/EP/BP

3-Amino 4-methylbenzyl alcohol3-(hydroxymethyl)-6-methylaniline(3-amino-4-methyl-phenyl)methanol(3-Amino-4-methylphenyl)methanol #SBB054776(3-amino-4-methylphenyl)methan-1-olAKOS0062239233-Amino-4-methylbenzyl alcohol, 97%

Database identifiers

CAS: 81863-45-8
PubChem CID: 586243
EC Number: 628-925-0
Nikkaji: J1.701.582F

Properties

Computed structural properties

XLogP: 0.6
Topological polar surface area: 46.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 105

Physicochemical properties

Melting point: 107 · 107-109 °C (lit.)
Boiling point: 297.5 · 297.5±25.0 °C(Predicted)
Density: 1.126 · 1.126±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
solubility: soluble in Methanol
form: powder to crystal
pka: 14.53 · 14.53±0.10(Predicted)
color: White to Light yellow to Light orange
InChI: 1S/C8H11NO/c1-6-2-3-7(5-10)4-8(6)9/h2-4,10H,5,9H2,1H3
InChIKey: BCQKYGYTOHXGLL-UHFFFAOYSA-N
SMILES: Cc1ccc(CO)cc1N
UNSPSC Code: 12352100 · 12352100
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
target organs: Respiratory system
PPE: 95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-37/39
WGK Germany: 3 · 3
HS Code: 2922.19 · 2922.19.7000
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.