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1190890-11-9 | 1-Pyrrolidinecarboxylic acid, 2-(aminomethyl)-, 1,1-dimethylethyl ester, hydrochloride (1:1), (2S)-
CAS No: 1190890-11-9 Catalog No: AG000I5X MDL No:MFCD11101392
Product Description
Catalog Number:
AG000I5X
Chemical Name:
1-Pyrrolidinecarboxylic acid, 2-(aminomethyl)-, 1,1-dimethylethyl ester, hydrochloride (1:1), (2S)-
CAS Number:
1190890-11-9
Molecular Formula:
C10H21ClN2O2
Molecular Weight:
236.7389
MDL Number:
MFCD11101392
IUPAC Name:
tert-butyl (2S)-2-(aminomethyl)pyrrolidine-1-carboxylate;hydrochloride
InChI:
InChI=1S/C10H20N2O2.ClH/c1-10(2,3)14-9(13)12-6-4-5-8(12)7-11;/h8H,4-7,11H2,1-3H3;1H/t8-;/m0./s1
InChI Key:
MQYQQPSDLQAGFQ-QRPNPIFTSA-N
SMILES:
NC[C@@H]1CCCN1C(=O)OC(C)(C)C.Cl
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
236.129g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.74g/mol
Monoisotopic Mass:
236.129g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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