Home Other Building Blocks 3-(2-methylpyrimidin-4-yl)propanoic acid

3-(2-methylpyrimidin-4-yl)propanoic acid

CAS No.:
933739-35-6
Catalog Number:
AG01B7PJ
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
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Product Description
Catalog Number:
AG01B7PJ
Chemical Name:
3-(2-methylpyrimidin-4-yl)propanoic acid
CAS Number:
933739-35-6
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
MDL Number:
MFCD24225786
IUPAC Name:
3-(2-methylpyrimidin-4-yl)propanoic acid
InChI:
InChI=1S/C8H10N2O2/c1-6-9-5-4-7(10-6)2-3-8(11)12/h4-5H,2-3H2,1H3,(H,11,12)
InChI Key:
DPNNXOQSGRYEAJ-UHFFFAOYSA-N
SMILES:
Cc1nc(CCC(=O)O)ccn1
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.074g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.18g/mol
Monoisotopic Mass:
166.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties