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

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

CAS No.:
1260655-08-0
Catalog Number:
AG01BTE4
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
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Product Description
Catalog Number:
AG01BTE4
Chemical Name:
methyl 1-cyclopropyl-1H-imidazole-4-carboxylate
CAS Number:
1260655-08-0
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
MDL Number:
MFCD11976048
IUPAC Name:
methyl 1-cyclopropylimidazole-4-carboxylate
InChI:
InChI=1S/C8H10N2O2/c1-12-8(11)7-4-10(5-9-7)6-2-3-6/h4-6H,2-3H2,1H3
InChI Key:
NRYPAFHGMRIZEL-UHFFFAOYSA-N
SMILES:
COC(=O)c1ncn(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:
0
Isotope Atom Count:
0
Molecular Weight:
166.18g/mol
Monoisotopic Mass:
166.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties