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Home > Other Heterocycles > 7106-04-9
7106-04-9 | 2-methylbicyclo[2.2.1]heptane-2-carbonitrile
CAS No: 7106-04-9 Catalog No: AG00OI6I MDL No:MFCD26838091
Product Description
Catalog Number:
AG00OI6I
Chemical Name:
2-methylbicyclo[2.2.1]heptane-2-carbonitrile
CAS Number:
7106-04-9
Molecular Formula:
C9H13N
Molecular Weight:
135.2062
MDL Number:
MFCD26838091
IUPAC Name:
2-methylbicyclo[2.2.1]heptane-2-carbonitrile
InChI:
InChI=1S/C9H13N/c1-9(6-10)5-7-2-3-8(9)4-7/h7-8H,2-5H2,1H3
InChI Key:
LCSPTWKFAMPAAU-UHFFFAOYSA-N
SMILES:
N#CC1(C)CC2CC1CC2
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.105g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.21g/mol
Monoisotopic Mass:
135.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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