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114649-21-7 | Cyclohexanamine, N-(2-methylpentylidene)-
CAS No: 114649-21-7 Catalog No: AG000EYA MDL No:
Product Description
Catalog Number:
AG000EYA
Chemical Name:
Cyclohexanamine, N-(2-methylpentylidene)-
CAS Number:
114649-21-7
Molecular Formula:
C12H23N
Molecular Weight:
181.3177
IUPAC Name:
N-cyclohexyl-2-methylpentan-1-imine
InChI:
InChI=1S/C12H23N/c1-3-7-11(2)10-13-12-8-5-4-6-9-12/h10-12H,3-9H2,1-2H3
InChI Key:
CMYNJSCNISRWAR-UHFFFAOYSA-N
SMILES:
CCCC(C=NC1CCCCC1)C
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.183g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.323g/mol
Monoisotopic Mass:
181.183g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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