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151602-30-1

151602-30-1 | 1-Pyrrolidineacetic acid, 2-[(aminocarbonyl)imino]-, hydrochloride (1:1)

CAS No: 151602-30-1 Catalog No: AG001NG9 MDL No:

Product Description

Catalog Number:
AG001NG9
Chemical Name:
1-Pyrrolidineacetic acid, 2-[(aminocarbonyl)imino]-, hydrochloride (1:1)
CAS Number:
151602-30-1
Molecular Formula:
C7H12ClN3O3
Molecular Weight:
221.6415
IUPAC Name:
2-(2-carbamoyliminopyrrolidin-1-yl)acetic acid;hydrochloride
InChI:
InChI=1S/C7H11N3O3.ClH/c8-7(13)9-5-2-1-3-10(5)4-6(11)12;/h1-4H2,(H2,8,13)(H,11,12);1H
InChI Key:
WYJQHPBKUJUJSP-UHFFFAOYSA-N
SMILES:
OC(=O)CN1CCCC1=NC(=O)N.Cl

Properties

Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.057g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
221.641g/mol
Monoisotopic Mass:
221.057g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  

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