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86027-00-1

86027-00-1 | Formic acid, compd. with 4,5-dimethyl-1H-imidazole (1:1)OTHER CA INDEX NAMES:1H-Imidazole, 4,5-dimethyl-, monoformate

CAS No: 86027-00-1 Catalog No: AG00IDV7 MDL No:MFCD28101701

Product Description

Catalog Number:
AG00IDV7
Chemical Name:
Formic acid, compd. with 4,5-dimethyl-1H-imidazole (1:1)OTHER CA INDEX NAMES:1H-Imidazole, 4,5-dimethyl-, monoformate
CAS Number:
86027-00-1
Molecular Formula:
C6H10N2O2
Molecular Weight:
142.1558
MDL Number:
MFCD28101701
IUPAC Name:
4,5-dimethyl-1H-imidazole;formic acid
InChI:
InChI=1S/C5H8N2.CH2O2/c1-4-5(2)7-3-6-4;2-1-3/h3H,1-2H3,(H,6,7);1H,(H,2,3)
InChI Key:
GSPFRBUPJBNHHJ-UHFFFAOYSA-N
SMILES:
Cc1[nH]cnc1C.OC=O

Properties

Complexity:
73.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.074g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
142.158g/mol
Monoisotopic Mass:
142.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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