Name: Name:(1R,2R)-Methyl 2-(4-bromobenzoyl)cyclopentanecarboxylate
Brand: Angene
SKU: AG0053G0
Rating: 90 (10 reviews)

(1R,2R)-Methyl 2-(4-bromobenzoyl)cyclopentanecarboxylate

CAS No.:

791594-14-4

Catalog Number:

AG0053G0

Molecular Formula:

C14H15BrO3

Molecular Weight:

311.1711

Catalog Number:

AG0053G0

Chemical Name:

(1R,2R)-Methyl 2-(4-bromobenzoyl)cyclopentanecarboxylate

CAS Number:

791594-14-4

Molecular Formula:

C14H15BrO3

Molecular Weight:

311.1711

MDL Number:

MFCD11977757

IUPAC Name:

methyl (1R,2R)-2-(4-bromobenzoyl)cyclopentane-1-carboxylate

InChI:

InChI=1S/C14H15BrO3/c1-18-14(17)12-4-2-3-11(12)13(16)9-5-7-10(15)8-6-9/h5-8,11-12H,2-4H2,1H3/t11-,12-/m1/s1

InChI Key:

XKJACWYQAFNKQK-VXGBXAGGSA-N

SMILES:

COC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)Br

Complexity:

321

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

310.02g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

311.175g/mol

Monoisotopic Mass:

310.02g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2