Home Other Building Blocks 2-(pyrimidin-5-yl)acetic acid hydrochloride

2-(pyrimidin-5-yl)acetic acid hydrochloride

CAS No.:
1222199-29-2
Catalog Number:
AG01BF9T
Molecular Formula:
C6H7ClN2O2
Molecular Weight:
174.5850
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Product Description
Catalog Number:
AG01BF9T
Chemical Name:
2-(pyrimidin-5-yl)acetic acid hydrochloride
CAS Number:
1222199-29-2
Molecular Formula:
C6H7ClN2O2
Molecular Weight:
174.5850
MDL Number:
MFCD28118536
IUPAC Name:
2-pyrimidin-5-ylacetic acid;hydrochloride
InChI:
InChI=1S/C6H6N2O2.ClH/c9-6(10)1-5-2-7-4-8-3-5;/h2-4H,1H2,(H,9,10);1H
InChI Key:
CQLBGLUNQXPKSB-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cncnc1.Cl
Properties
Complexity:
121  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.02g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
174.584g/mol
Monoisotopic Mass:
174.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties