Name: Name:1-Pyrrolidinecarboxylic acid, 3-bromo-4-hydroxy-, phenylmethyl ester
Brand: Angene
SKU: AG00ID2W
Rating: 90 (10 reviews)

1-Pyrrolidinecarboxylic acid, 3-bromo-4-hydroxy-, phenylmethyl ester

CAS No.:

799767-82-1

Catalog Number:

AG00ID2W

Molecular Formula:

C12H14BrNO3

Molecular Weight:

300.1485

Catalog Number:

AG00ID2W

Chemical Name:

1-Pyrrolidinecarboxylic acid, 3-bromo-4-hydroxy-, phenylmethyl ester

CAS Number:

799767-82-1

Molecular Formula:

C12H14BrNO3

Molecular Weight:

300.1485

MDL Number:

MFCD30179672

IUPAC Name:

benzyl 3-bromo-4-hydroxypyrrolidine-1-carboxylate

InChI:

InChI=1S/C12H14BrNO3/c13-10-6-14(7-11(10)15)12(16)17-8-9-4-2-1-3-5-9/h1-5,10-11,15H,6-8H2

InChI Key:

VAZVNQCDCZKURA-UHFFFAOYSA-N

SMILES:

BrC1CN(CC1O)C(=O)OCc1ccccc1

Complexity:

269

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

299.016g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

300.152g/mol

Monoisotopic Mass:

299.016g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6