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Home > Indoles and Oxindole > 97961-97-2
97961-97-2 | Spiro[cyclohexane-1,3'-[3H]indole], 1',2'-dihydro-2'-(phenylmethyl)-
CAS No: 97961-97-2 Catalog No: AG00H6X6 MDL No:
Product Description
Catalog Number:
AG00H6X6
Chemical Name:
Spiro[cyclohexane-1,3'-[3H]indole], 1',2'-dihydro-2'-(phenylmethyl)-
CAS Number:
97961-97-2
Molecular Formula:
C20H23N
Molecular Weight:
277.4033
IUPAC Name:
2-benzylspiro[1,2-dihydroindole-3,1'-cyclohexane]
InChI:
InChI=1S/C20H23N/c1-3-9-16(10-4-1)15-19-20(13-7-2-8-14-20)17-11-5-6-12-18(17)21-19/h1,3-6,9-12,19,21H,2,7-8,13-15H2
InChI Key:
FEAJXIFGXGGIJC-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CC1Nc2c(C31CCCCC3)cccc2
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.183g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.411g/mol
Monoisotopic Mass:
277.183g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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