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143877-30-9

143877-30-9 | Cyclohexene, 4-(2-nitro-1-propen-1-yl)-

CAS No: 143877-30-9 Catalog No: AG001IIP MDL No:

Product Description

Catalog Number:
AG001IIP
Chemical Name:
Cyclohexene, 4-(2-nitro-1-propen-1-yl)-
CAS Number:
143877-30-9
Molecular Formula:
C9H13NO2
Molecular Weight:
167.2050
IUPAC Name:
4-(2-nitroprop-1-enyl)cyclohexene
InChI:
InChI=1S/C9H13NO2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h2-3,7,9H,4-6H2,1H3
InChI Key:
OWOHMVCQYROEPK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C(=CC1CCC=CC1)C

Properties

Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.095g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.208g/mol
Monoisotopic Mass:
167.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.7  

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