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Home > Nitro Compounds > 98431-67-5
98431-67-5 | (2-Nitrovinyl)cyclopentane
CAS No: 98431-67-5 Catalog No: AG00IK32 MDL No:MFCD00094042
Product Description
Catalog Number:
AG00IK32
Chemical Name:
(2-Nitrovinyl)cyclopentane
CAS Number:
98431-67-5
Molecular Formula:
C7H11NO2
Molecular Weight:
141.1677
MDL Number:
MFCD00094042
IUPAC Name:
[(E)-2-nitroethenyl]cyclopentane
InChI:
InChI=1S/C7H11NO2/c9-8(10)6-5-7-3-1-2-4-7/h5-7H,1-4H2/b6-5+
InChI Key:
QJUJQXPQQYTYQZ-AATRIKPKSA-N
SMILES:
[O-][N+](=O)/C=C/C1CCCC1
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
141.079g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.17g/mol
Monoisotopic Mass:
141.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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