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1150644-39-5

1150644-39-5 | 4-Pyrimidinecarboxylic acid, 2-(ethylamino)-6-methyl-

CAS No: 1150644-39-5 Catalog No: AG000FUU MDL No:

Product Description

Catalog Number:
AG000FUU
Chemical Name:
4-Pyrimidinecarboxylic acid, 2-(ethylamino)-6-methyl-
CAS Number:
1150644-39-5
Molecular Formula:
C8H11N3O2
Molecular Weight:
181.1918
IUPAC Name:
2-(ethylamino)-6-methylpyrimidine-4-carboxylic acid
InChI:
InChI=1S/C8H11N3O2/c1-3-9-8-10-5(2)4-6(11-8)7(12)13/h4H,3H2,1-2H3,(H,12,13)(H,9,10,11)
InChI Key:
PHIPVJYYOZDRQV-UHFFFAOYSA-N
SMILES:
CCNc1nc(C)cc(n1)C(=O)O

Properties

Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.085g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
181.195g/mol
Monoisotopic Mass:
181.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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