Name: Name:4-Pyridinepropanoic acid, β-amino-, methyl ester, hydrochloride (1:2)
Brand: Angene
SKU: AG0012LM
Rating: 90 (10 reviews)

4-Pyridinepropanoic acid, β-amino-, methyl ester, hydrochloride (1:2)

CAS No.:

1369501-61-0

Catalog Number:

AG0012LM

Molecular Formula:

C9H14Cl2N2O2

Molecular Weight:

253.1257

Catalog Number:

AG0012LM

Chemical Name:

4-Pyridinepropanoic acid, β-amino-, methyl ester, hydrochloride (1:2)

CAS Number:

1369501-61-0

Molecular Formula:

C9H14Cl2N2O2

Molecular Weight:

253.1257

MDL Number:

MFCD06740412

IUPAC Name:

methyl 3-amino-3-pyridin-4-ylpropanoate;dihydrochloride

InChI:

InChI=1S/C9H12N2O2.2ClH/c1-13-9(12)6-8(10)7-2-4-11-5-3-7;;/h2-5,8H,6,10H2,1H3;2*1H

InChI Key:

NSTORCLCXFBAKE-UHFFFAOYSA-N

SMILES:

COC(=O)CC(c1ccncc1)N.Cl.Cl

Complexity:

167

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

252.043g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

253.123g/mol

Monoisotopic Mass:

252.043g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

65.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: