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Substance Name: 1-Bromo-4-(1,1-dimethylethyl)benzene
RN: 3972-65-4
InChIKey: XHCAGOVGSDHHNP-UHFFFAOYSA-N

Molecular Formula

  • C10-H13-Br

Molecular Weight

  • 213.117
 
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Names and Synonyms

Synonym

  • EINECS 223-599-2

Systematic Name

  • 1-Bromo-4-(1,1-dimethylethyl)benzene

Registry Numbers

CAS Registry Number

  • 3972-65-4

System Generated Number

  • 0003972654

Structure Descriptors

InChI

1S/C10H13Br/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7H,1-3H3

InChIKey

XHCAGOVGSDHHNP-UHFFFAOYSA-N

Smiles

C(c1ccc(cc1)Br)(C)(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 19 deg C   EXP
Boiling Point 231.5 deg C   EXP
log P (octanol-water) 4.790 (none)   EST
Atmospheric OH Rate Constant 1.97E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.