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102450-00-0 | Cyclohexaneethanamine, 2-methyl-
CAS No: 102450-00-0 Catalog No: AG0007IO MDL No:MFCD07772984
Product Description
Catalog Number:
AG0007IO
Chemical Name:
Cyclohexaneethanamine, 2-methyl-
CAS Number:
102450-00-0
Molecular Formula:
C9H19N
Molecular Weight:
141.2539
MDL Number:
MFCD07772984
IUPAC Name:
2-(2-methylcyclohexyl)ethanamine
InChI:
InChI=1S/C9H19N/c1-8-4-2-3-5-9(8)6-7-10/h8-9H,2-7,10H2,1H3
InChI Key:
BXKLFCREVJPUJY-UHFFFAOYSA-N
SMILES:
NCCC1CCCCC1C
Properties
Complexity:
90.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.152g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
141.258g/mol
Monoisotopic Mass:
141.152g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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