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207450-10-0 | 1,2-Cyclohexanediamine, N1,N2-bis(2,2-dimethylpropyl)-, (1R,2R)-
CAS No: 207450-10-0 Catalog No: AG002J2F MDL No:
Product Description
Catalog Number:
AG002J2F
Chemical Name:
1,2-Cyclohexanediamine, N1,N2-bis(2,2-dimethylpropyl)-, (1R,2R)-
CAS Number:
207450-10-0
Molecular Formula:
C16H34N2
Molecular Weight:
254.4546
IUPAC Name:
(1R,2R)-1-N,2-N-bis(2,2-dimethylpropyl)cyclohexane-1,2-diamine
InChI:
InChI=1S/C16H34N2/c1-15(2,3)11-17-13-9-7-8-10-14(13)18-12-16(4,5)6/h13-14,17-18H,7-12H2,1-6H3/t13-,14-/m1/s1
InChI Key:
SBKKECFWOOOBAA-ZIAGYGMSSA-N
SMILES:
CC(CN[C@@H]1CCCC[C@H]1NCC(C)(C)C)(C)C
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
254.272g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
254.462g/mol
Monoisotopic Mass:
254.272g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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