Name: Name:2-Propenoic acid, 3-(4-chlorophenyl)-, 1,1-dimethylethyl ester, (2E)-
Brand: Angene
SKU: AG01CAE5
Rating: 90 (10 reviews)

2-Propenoic acid, 3-(4-chlorophenyl)-, 1,1-dimethylethyl ester, (2E)-

CAS No.:

125950-99-4

Catalog Number:

AG01CAE5

Molecular Formula:

C13H15ClO2

Molecular Weight:

238.7100

Catalog Number:

AG01CAE5

Chemical Name:

2-Propenoic acid, 3-(4-chlorophenyl)-, 1,1-dimethylethyl ester, (2E)-

CAS Number:

125950-99-4

Molecular Formula:

C13H15ClO2

Molecular Weight:

238.7100

MDL Number:

MFCD24879651

IUPAC Name:

tert-butyl 3-(4-chlorophenyl)prop-2-enoate

InChI:

InChI=1S/C13H15ClO2/c1-13(2,3)16-12(15)9-6-10-4-7-11(14)8-5-10/h4-9H,1-3H3

InChI Key:

BMIKRPUHJWEHQJ-UHFFFAOYSA-N

SMILES:

O=C(OC(C)(C)C)/C=C/c1ccc(cc1)Cl

Complexity:

258

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

238.076g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

238.711g/mol

Monoisotopic Mass:

238.076g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8