Name: Name:1-Pyrrolidinecarboxylic acid, 3-(aminomethyl)-, phenylmethyl ester, hydrochloride (1:1), (3S)-
Brand: Angene
SKU: AG0015UB
Rating: 90 (10 reviews)

1-Pyrrolidinecarboxylic acid, 3-(aminomethyl)-, phenylmethyl ester, hydrochloride (1:1), (3S)-

CAS No.:

1217619-19-6

Catalog Number:

AG0015UB

Molecular Formula:

C13H19ClN2O2

Molecular Weight:

270.7552

Catalog Number:

AG0015UB

Chemical Name:

1-Pyrrolidinecarboxylic acid, 3-(aminomethyl)-, phenylmethyl ester, hydrochloride (1:1), (3S)-

CAS Number:

1217619-19-6

Molecular Formula:

C13H19ClN2O2

Molecular Weight:

270.7552

MDL Number:

MFCD11101251

IUPAC Name:

benzyl (3S)-3-(aminomethyl)pyrrolidine-1-carboxylate;hydrochloride

InChI:

InChI=1S/C13H18N2O2.ClH/c14-8-12-6-7-15(9-12)13(16)17-10-11-4-2-1-3-5-11;/h1-5,12H,6-10,14H2;1H/t12-;/m0./s1

InChI Key:

BLKKIXMBFFDIOD-YDALLXLXSA-N

SMILES:

NC[C@@H]1CCN(C1)C(=O)OCc1ccccc1.Cl

Complexity:

252

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

270.114g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

270.757g/mol

Monoisotopic Mass:

270.114g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: