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88141-64-4 | 2-Cyclohexen-1-ol, 6-[(1-methylethyl)amino]-3-(1-naphthalenyl)-, trans-
CAS No: 88141-64-4 Catalog No: AG004D8M MDL No:
Product Description
Catalog Number:
AG004D8M
Chemical Name:
2-Cyclohexen-1-ol, 6-[(1-methylethyl)amino]-3-(1-naphthalenyl)-, trans-
CAS Number:
88141-64-4
Molecular Formula:
C19H23NO
Molecular Weight:
281.3920
IUPAC Name:
(1R,6R)-3-naphthalen-1-yl-6-(propan-2-ylamino)cyclohex-2-en-1-ol
InChI:
InChI=1S/C19H23NO/c1-13(2)20-18-11-10-15(12-19(18)21)17-9-5-7-14-6-3-4-8-16(14)17/h3-9,12-13,18-21H,10-11H2,1-2H3/t18-,19-/m1/s1
InChI Key:
VZKJKFFILGUUJN-RTBURBONSA-N
SMILES:
CC(N[C@@H]1CCC(=C[C@H]1O)c1cccc2c1cccc2)C
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
281.178g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
281.399g/mol
Monoisotopic Mass:
281.178g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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