Name: Name:Benzeneacetic acid, 3-bromo-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG00I3LZ
Rating: 90 (10 reviews)

Benzeneacetic acid, 3-bromo-, 1,1-dimethylethyl ester

CAS No.:

197792-52-2

Catalog Number:

AG00I3LZ

Molecular Formula:

C12H15BrO2

Molecular Weight:

271.1503

Catalog Number:

AG00I3LZ

Chemical Name:

Benzeneacetic acid, 3-bromo-, 1,1-dimethylethyl ester

CAS Number:

197792-52-2

Molecular Formula:

C12H15BrO2

Molecular Weight:

271.1503

MDL Number:

MFCD19026476

IUPAC Name:

tert-butyl 2-(3-bromophenyl)acetate

InChI:

InChI=1S/C12H15BrO2/c1-12(2,3)15-11(14)8-9-5-4-6-10(13)7-9/h4-7H,8H2,1-3H3

InChI Key:

IUQYZZLJRJUKIH-UHFFFAOYSA-N

SMILES:

O=C(OC(C)(C)C)Cc1cccc(c1)Br

Complexity:

220

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

270.026g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

271.154g/mol

Monoisotopic Mass:

270.026g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.7