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100-60-7 | Cyclohexanamine, N-methyl-
CAS No: 100-60-7 Catalog No: AG000076 MDL No:MFCD00003832
Product Description
Catalog Number:
AG000076
Chemical Name:
Cyclohexanamine, N-methyl-
CAS Number:
100-60-7
Molecular Formula:
C7H15N
Molecular Weight:
113.2007
MDL Number:
MFCD00003832
IUPAC Name:
N-methylcyclohexanamine
InChI:
InChI=1S/C7H15N/c1-8-7-5-3-2-4-6-7/h7-8H,2-6H2,1H3
InChI Key:
XTUVJUMINZSXGF-UHFFFAOYSA-N
SMILES:
CNC1CCCCC1
EC Number:
202-869-3
UNII:
YH8PF4C1OW
NSC Number:
434
UN Number:
2924
Properties
Complexity:
55.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.12g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
113.204g/mol
Monoisotopic Mass:
113.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Cyclo-hex-yl(meth-yl)ammonium {bis-[cyclo-hex-yl(meth-yl)amino]-phosphor-yl}(4-methyl-phenyl-sulfon-yl)aza-nide. | Acta crystallographica. Section E, Structure reports online 20111001 |
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