2-Chloro-6-methylbenzylamine

HCID 521799

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Basic information

CAS: 57264-46-7
Standard SMILES: Cc1cccc(Cl)c1CN
InChIKey: WPQIAYXZZULKMV-UHFFFAOYSA-N
Molecular formula: C8H10ClN
Average molar mass: 155.62 g/mol
Monoisotopic mass: 155.050177

Names & identifiers

Preferred name: 2-Chloro-6-methylbenzylamine
IUPAC: (2-chloro-6-methylphenyl)methanamine
English name: 2-Chloro-6-methylbenzylamine
Molecular formula: C8H10ClN
Molecular weight: 155.62

Names & synonyms

2-Chloro-6-methylbenzylamine57264-46-7DTXSID40334735RefChem:259133DTXCID90285824WPQIAYXZZULKMV-UHFFFAOYSA-N(2-Chloro-6-methylphenyl)methanamine1-(2-chloro-6-methylphenyl)methanamineMFCD000528102-chloro-6-methyl-benzylamineSCHEMBL1127909SCHEMBL1225784

Show more names

RARECHEM AL BW 0149Benzenemethanamine, 2-chloro-6-methyl-

(6-chloro-2-methylphenyl)methylamine(2-chloro-6-methyl-phenyl)methanamineSB76216(2-Chloro-6-methylphenyl)methanamine #2-Chloro-6-methylbenzylamine, AldrichCPRBS-53329DA-04752SY101211

Database identifiers

CAS: 57264-46-7
PubChem CID: 521799
DTXSID: DTXSID40334735
EC Number: 679-474-1

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 105

Physicochemical properties

Boiling point: 110 · 110-112°C 15mm
Density: 1.13 · 1.130±0.06 g/cm3(Predicted)
refractive index: 1.559 · 1.5590
Flash point: 110 · 110-112°C/15mm
storage temp.: 2 · 2-8°C
pka: 8.7 · 8.70±0.10(Predicted)
form: solid
Sensitive: Air Sensitive
BRN: 2828602 · 2828602
InChI: 1S/C8H10ClN/c1-6-3-2-4-8(9)7(6)5-10/h2-4H,5,10H2,1H3
InChIKey: WPQIAYXZZULKMV-UHFFFAOYSA-N
SMILES: Cc1cccc(Cl)c1CN
UNSPSC Code: 12352116 · 12352116
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314-H318
Precautionary statements: 260 h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a · P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a
Hazard Codes: Xi
Risk Statements: 34 · 34-41
Safety Statements: 26 · 26-36/37/39
RIDADR: 2735 · 2735
WGK Germany: 3 · WGK 3
HazardClass: 8 · 8
PackingGroup: III
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 1 · Eye Dam. 1

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H314 (80%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, 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

Hazard Classes and CategoriesEye Dam. 1 (20%)

Safety data

wgk: WGK 3
ridadr: 2735
risk_code: 34-41
Signal word: Danger
Symbol(GHS): GHS05
hazard_code: Xi
safety_code: 26-36/37/39
hazard_class: 8
Storage Class: 11 - Combustible Solids
packing_group: III
Hazard statements: H314-H318
Hazard Classifications: Eye Dam. 1
Precautionary statements: P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a