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141672-62-0 | Cyclohexanecarboxylic acid, 4-(aminomethyl)-, tetradecyl ester, trans-
CAS No: 141672-62-0 Catalog No: AG001GVG MDL No:
Product Description
Catalog Number:
AG001GVG
Chemical Name:
Cyclohexanecarboxylic acid, 4-(aminomethyl)-, tetradecyl ester, trans-
CAS Number:
141672-62-0
Molecular Formula:
C22H43NO2
Molecular Weight:
353.5823
IUPAC Name:
tetradecyl 4-(aminomethyl)cyclohexane-1-carboxylate
InChI:
InChI=1S/C22H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-18-25-22(24)21-16-14-20(19-23)15-17-21/h20-21H,2-19,23H2,1H3
InChI Key:
NPDUKVNRDVXIRD-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCOC(=O)[C@@H]1CC[C@H](CC1)CN
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.329g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
353.591g/mol
Monoisotopic Mass:
353.329g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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