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Home > Nitro Compounds > 107945-66-4
107945-66-4 | 1H-1,2,3-Triazole, 1-methyl-4-nitro-
CAS No: 107945-66-4 Catalog No: AG00HB21 MDL No:MFCD28128966
Product Description
Catalog Number:
AG00HB21
Chemical Name:
1H-1,2,3-Triazole, 1-methyl-4-nitro-
CAS Number:
107945-66-4
MDL Number:
MFCD28128966
IUPAC Name:
1-methyl-4-nitrotriazole
InChI:
InChI=1S/C3H4N4O2/c1-6-2-3(4-5-6)7(8)9/h2H,1H3
InChI Key:
QSSICHXGTFGQSX-UHFFFAOYSA-N
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.033g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.091g/mol
Monoisotopic Mass:
128.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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