CAS 119027-36-0 1-Bromo-4-(2-methoxypropan-2-yl)benzene (HCID 15072385)

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Basic information

CAS: 119027-36-0
Standard SMILES: COC(C)(C)c1ccc(Br)cc1
InChIKey: SVSUUYAOGAZDBT-UHFFFAOYSA-N
Molecular formula: C10H13BrO
Average molar mass: 229.11 g/mol
Monoisotopic mass: 228.01497714

Names & identifiers

Preferred name: 1-Bromo-4-(2-methoxypropan-2-yl)benzene
IUPAC: 1-bromo-4-(2-methoxypropan-2-yl)benzene
English name: 1-bromo-4-(2-methoxypropan-2-yl)benzene
Molecular formula: C10H13BrO
Molecular weight: 229.11

Names & synonyms

1-Bromo-4-(2-methoxypropan-2-yl)benzene119027-36-0DTXSID40567809RefChem:228558DTXCID90518583823-758-1Benzene, 1-bromo-4-(1-methoxy-1-methylethyl)-SCHEMBL1738300SVSUUYAOGAZDBT-UHFFFAOYSA-NUEA02736MFCD18205636AKOS030238894

Show more names

DA-296471-Bromo-4-(1-methoxy-1-methyl-ethyl)-benzene1-Bromo-4-(1-methoxy-1-methylethyl)-benzeneEN300-317830Z1269200225

Database identifiers

CAS: 119027-36-0
PubChem CID: 15072385
DTXSID: DTXSID40567809
EC Number: 823-758-1

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 12
Formal charge: 0
Complexity: 137

Physicochemical properties

Boiling point: 244.1 · 244.1±15.0 °C(Predicted)
Density: 1.282 · 1.282±0.06 g/cm3(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H319-H335-H315
Precautionary statements: 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501

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, 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.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H319-H335-H315
Precautionary statements: P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501