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100617-42-3 | Benzenemethanamine, 4-(cyclohexyloxy)-
CAS No: 100617-42-3 Catalog No: AG0002HT MDL No:MFCD08699726
Product Description
Catalog Number:
AG0002HT
Chemical Name:
Benzenemethanamine, 4-(cyclohexyloxy)-
CAS Number:
100617-42-3
Molecular Formula:
C13H19NO
Molecular Weight:
205.2961
MDL Number:
MFCD08699726
IUPAC Name:
(4-cyclohexyloxyphenyl)methanamine
InChI:
InChI=1S/C13H19NO/c14-10-11-6-8-13(9-7-11)15-12-4-2-1-3-5-12/h6-9,12H,1-5,10,14H2
InChI Key:
TZGIKTKRPOBYLW-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)OC1CCCCC1
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.147g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.301g/mol
Monoisotopic Mass:
205.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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