Home Carboxys 1-Pyrrolidinecarboxylic acid, 3-(aminomethyl)-, phenylmethyl ester, hydrochloride (1:1), (3R)-

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

CAS No.:
1217726-65-2
Catalog Number:
AG0015XZ
Molecular Formula:
C13H19ClN2O2
Molecular Weight:
270.7552
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Product Description
Catalog Number:
AG0015XZ
Chemical Name:
1-Pyrrolidinecarboxylic acid, 3-(aminomethyl)-, phenylmethyl ester, hydrochloride (1:1), (3R)-
CAS Number:
1217726-65-2
Molecular Formula:
C13H19ClN2O2
Molecular Weight:
270.7552
MDL Number:
MFCD11101210
IUPAC Name:
benzyl (3R)-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-;/m1./s1
InChI Key:
BLKKIXMBFFDIOD-UTONKHPSSA-N
SMILES:
NC[C@H]1CCN(C1)C(=O)OCc1ccccc1.Cl
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
270.114g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
270.757g/mol
Monoisotopic Mass:
270.114g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties