Home Carboxys (2S)-1-[(2-methyl-2H-1,2,3,4-tetrazol-5-yl)methyl]pyrrolidine-2-carboxylic acid hydrochloride

(2S)-1-[(2-methyl-2H-1,2,3,4-tetrazol-5-yl)methyl]pyrrolidine-2-carboxylic acid hydrochloride

CAS No.:
2137092-55-6
Catalog Number:
AG01EKZE
Molecular Formula:
C8H14ClN5O2
Molecular Weight:
247.6821
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Product Description
Catalog Number:
AG01EKZE
Chemical Name:
(2S)-1-[(2-methyl-2H-1,2,3,4-tetrazol-5-yl)methyl]pyrrolidine-2-carboxylic acid hydrochloride
CAS Number:
2137092-55-6
Molecular Formula:
C8H14ClN5O2
Molecular Weight:
247.6821
MDL Number:
MFCD31559349
IUPAC Name:
(2S)-1-[(2-methyltetrazol-5-yl)methyl]pyrrolidine-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C8H13N5O2.ClH/c1-12-10-7(9-11-12)5-13-4-2-3-6(13)8(14)15;/h6H,2-5H2,1H3,(H,14,15);1H/t6-;/m0./s1
InChI Key:
UKJOMBQJRVXQKN-RGMNGODLSA-N
SMILES:
OC(=O)[C@@H]1CCCN1Cc1nnn(n1)C.Cl
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
247.084g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
247.683g/mol
Monoisotopic Mass:
247.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties