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Home > Nitro Compounds > 143957-74-8

143957-74-8

143957-74-8 | Bicyclo[3.1.1]heptane, 6,6-dimethyl-2-(nitromethyl)-

CAS No: 143957-74-8 Catalog No: AG001INO MDL No:

Product Description

Catalog Number:
AG001INO
Chemical Name:
Bicyclo[3.1.1]heptane, 6,6-dimethyl-2-(nitromethyl)-
CAS Number:
143957-74-8
Molecular Formula:
C10H17NO2
Molecular Weight:
183.2475
IUPAC Name:
6,6-dimethyl-2-(nitromethyl)bicyclo[3.1.1]heptane
InChI:
InChI=1S/C10H17NO2/c1-10(2)8-4-3-7(6-11(12)13)9(10)5-8/h7-9H,3-6H2,1-2H3
InChI Key:
WPVQQBFDTRDXML-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)CC1CCC2CC1C2(C)C

Properties

Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.126g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.251g/mol
Monoisotopic Mass:
183.126g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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