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13141-50-9 | Spiro[cyclohexane-1,3'-[3H]indole], 2'-methyl-
CAS No: 13141-50-9 Catalog No: AG00736X MDL No:
Product Description
Catalog Number:
AG00736X
Chemical Name:
Spiro[cyclohexane-1,3'-[3H]indole], 2'-methyl-
CAS Number:
13141-50-9
Molecular Formula:
C14H17N
Molecular Weight:
199.2915
IUPAC Name:
2'-methylspiro[cyclohexane-1,3'-indole]
InChI:
InChI=1S/C14H17N/c1-11-14(9-5-2-6-10-14)12-7-3-4-8-13(12)15-11/h3-4,7-8H,2,5-6,9-10H2,1H3
InChI Key:
ZUGVGHVFSDZSNW-UHFFFAOYSA-N
SMILES:
CC1=Nc2c(C31CCCCC3)cccc2
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.297g/mol
Monoisotopic Mass:
199.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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