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1268142-57-9 | Spiro[cyclopentane-1,4'(1'H)-isoquinoline], 2',3'-dihydro-7'-methyl-
CAS No: 1268142-57-9 Catalog No: AG000T9J MDL No:
Product Description
Catalog Number:
AG000T9J
Chemical Name:
Spiro[cyclopentane-1,4'(1'H)-isoquinoline], 2',3'-dihydro-7'-methyl-
CAS Number:
1268142-57-9
Molecular Formula:
C14H19N
Molecular Weight:
201.3074
IUPAC Name:
7-methylspiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopentane]
InChI:
InChI=1S/C14H19N/c1-11-4-5-13-12(8-11)9-15-10-14(13)6-2-3-7-14/h4-5,8,15H,2-3,6-7,9-10H2,1H3
InChI Key:
SJXXFGQBGXWHCL-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)CNCC12CCCC1
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.152g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.313g/mol
Monoisotopic Mass:
201.152g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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