1-(Bromomethyl)-2-phenylbenzene

HCID 263365

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Basic information

CAS: 19853-09-9
Standard SMILES: BrCc1ccccc1-c1ccccc1
InChIKey: SEXZHJJUKFXNDY-UHFFFAOYSA-N
Molecular formula: C13H11Br
Average molar mass: 247.13 g/mol
Monoisotopic mass: 246.00441245

Names & identifiers

Preferred name: 1-(Bromomethyl)-2-phenylbenzene
IUPAC: 1-(bromomethyl)-2-phenylbenzene
English name: 2-PHENYLBENZYL BROMIDE
Molecular formula: C13H11Br
Molecular weight: 247.13

Names & synonyms

1-(bromomethyl)-2-phenylbenzeneRefChem:427246628-751-52-Phenylbenzyl bromide19853-09-92-phenylbenzylbromide2-(Bromomethyl)biphenyl2-(bromomethyl)-1,1'-biphenyl1,1'-Biphenyl, 2-(bromomethyl)-MFCD00075454bromomethylbiphenylbromomethyl biphenyl

Show more names

2-Phenylbenzyl broMide 97%

6-Fluoro-2-(2'-fluoro[1,1'-biphenyl]-4-yl)-3-methyl-4-quinolinecarboxylic Acid Sodium; Biphenquinate Sodium; DuP 785; NSC 368390NSC977722-Bromomethylbiphenylo-phenylbenzyl bromide(bromomethyl) biphenyl2-phenyl benzyl bromide2-phenyl-benzyl bromide2-(Bromomethyl)-biphenyl

Database identifiers

CAS: 19853-09-9
PubChem CID: 263365
DTXSID: DTXSID70294737
EC Number: 628-751-5
Nikkaji: J1.355.904J

Properties

Computed structural properties

XLogP: 4.1
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 2
Heavy atoms: 14
Formal charge: 0
Complexity: 161

Physicochemical properties

Melting point: 45 · 45-46 °C
Boiling point: 120 · 120-125 °C/0.1 mmHg (lit.)
Density: 1.353 g/mL · 1.353 g/mL at 25 °C (lit.)
refractive index: 20 · n20/D 1.6280(lit.)
Flash point: 230 °F · >230 °F
storage temp.: 2 · Storage temp. 2-8°C
form: liquid
Appearance: Colorless to light yellow Liquid
InChI: 1S/C13H11Br/c14-10-12-8-4-5-9-13(12)11-6-2-1-3-7-11/h1-9H,10H2
InChIKey: SEXZHJJUKFXNDY-UHFFFAOYSA-N
SMILES: BrCc1ccccc1-c2ccccc2
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 280 · P280-P305+P351+P338-P310
PPE: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
Hazard Codes: C
Risk Statements: 34 · 34
Safety Statements: 26 · 26-27-28-36/37/39
RIDADR: 3265 · UN 3265 8/PG 2
WGK Germany: 3 · 3
HazardClass: 8 · 8
PackingGroup: III
HS Code: 2903998090 · 2903998090
Storage Class: 8 A · 8A - Combustible corrosive hazardous materials
Hazard Classifications: 1 Skin · Eye Dam. 1Skin Corr. 1B

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H314 (100%): 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 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.