(4-Bromo-2-fluorophenyl)methanamine (HCID 3770848)

Names & identifiers

Preferred name: (4-Bromo-2-fluorophenyl)methanamine
IUPAC: (4-bromo-2-fluorophenyl)methanamine
English name: 4-Bromo-2-fluorobenzylamine
Molecular formula: C7H7BrFN
Molecular weight: 204.04

Names & synonyms

(4-bromo-2-fluorophenyl)methanamineRefChem:402486642-674-44-BROMO-2-FLUOROBENZYLAMINE112734-22-22-fluoro-4-bromobenzylamine1-(4-bromo-2-fluorophenyl)methanamine2-Fluoro-4-bromobenzyl amine4-Bromo-2-fluorobenzyl amineMFCD00153076(4-bromo-2-fluoro-phenyl)methanamine(4-bromo-2-fluorophenyl) methanamine

Show more names

MINA-002TIMTEC-BB SBB005778RARECHEM AL BW 07724-Bromo-2-fluorobenzylamine,99%2-Fluoro-4-Bromobenzylamine HCl4-Bromo-2-fluorobenzenemethanamine4-BroMo-2-fluorobenzylaMine, 99% 5GR

CS-W004742AC-1967SY033189EN300-144216(4-bromo-2-fluorophenyl)methylamineBenzenemethanamine, 4-bromo-2-fluoro-4-Bromo-2-fluoroFT-0617776

Database identifiers

CAS: 112734-22-2
PubChem CID: 3770848
DTXSID: DTXSID00396192
EC Number: 642-674-4
Nikkaji: J2.403.725H

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 110

Physicochemical properties

Boiling point: 244.5 · 244.5±25.0 °C(Predicted)
Density: 1.571 · 1.571±0.06 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka: 8.43 · 8.43±0.10(Predicted)
form: Liquid
Specific Gravity: 1.58 · 1.58
color: Clear colorless to slightly yellow
InChI: InChI=1S/C7H7BrFN/c8-6-2-1-5(4-10)7(9)3-6/h1-3H,4,10H2
InChIKey: RLTFBWCBGIZCDQ-UHFFFAOYSA-N
SMILES: C1(CN)=CC=C(Br)C=C1F
CAS DataBase Reference: 112734 · 112734-22-2(CAS DataBase Reference)
UNSPSC Code: 12352116 · 12352116
Symbol(GHS): 5 · GHS05,GHS07
Signal word: Danger
Hazard statements: 302 · H302+H312+H332-H314
Precautionary statements: 501 · P501-P261-P270-P271-P264-P280-P362+P364-P303+P361+P353-P301+P330+P331-P301+P312+P330-P304+P340+P310-P305+P351+P338+P310-P405
Hazard Codes: C,Xi
Risk Statements: 34 · 34-21/22-36
Safety Statements: 45 · 45-36/37/39-26
RIDADR: 2735 · 2735
WGK Germany: 3 · WGK 3
Hazard Note: Irritant
HazardClass: 8 · 8
PackingGroup: Ⅲ
HS Code: 29214900 · 29214900
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 · Eye Irrit. 2
Limited Quantities: 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302 (75%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P321, P330, P337+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 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 CategoriesAcute Tox. 4 (75%)

Safety data

wgk: WGK 3
ridadr: 2735
hs_code: 29214900
risk_code: 34-21/22-36
Signal word: Danger
Symbol(GHS): GHS05,GHS07
hazard_code: C,Xi
hazard_note: Irritant
safety_code: 45-36/37/39-26
hazard_class: 8
Storage Class: 11 - Combustible Solids
packing_group: Ⅲ
Hazard statements: H302+H312+H332-H314
Limited Quantities: 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Hazard Classifications: Eye Irrit. 2
Precautionary statements: P501-P261-P270-P271-P264-P280-P362+P364-P303+P361+P353-P301+P330+P331-P301+P312+P330-P304+P340+P310-P305+P351+P338+P310-P405