Home Carboxys methyl 2-cyclopropyl-1H-imidazole-4-carboxylate

methyl 2-cyclopropyl-1H-imidazole-4-carboxylate

CAS No.:
1250136-57-2
Catalog Number:
AG019ZFW
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
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Product Description
Catalog Number:
AG019ZFW
Chemical Name:
methyl 2-cyclopropyl-1H-imidazole-4-carboxylate
CAS Number:
1250136-57-2
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
MDL Number:
MFCD16699423
IUPAC Name:
methyl 2-cyclopropyl-1H-imidazole-5-carboxylate
InChI:
InChI=1S/C8H10N2O2/c1-12-8(11)6-4-9-7(10-6)5-2-3-5/h4-5H,2-3H2,1H3,(H,9,10)
InChI Key:
SGLGHHLKCJNINF-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc([nH]c1)C1CC1
Properties
Complexity:
192  
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:
3  
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:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties