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Home> Hot Product Listed N   > N-methyl-5-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-amine hydrochloride
82115-62-6 structure

N-methyl-5-phenyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-amine hydrochloride

CAS No.:82115-62-6
Molecular Weight:272.38196
Molecular Formula:C15H17NO4·CLH (isomer)
Names and Identifiers
Synonyms

5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N-methyl-5-phenyl-, hydrochloride 6,7,8,9-Tetrahydro-N-methyl-5-phenyl-5H-benzocyclohepten-7-amine hydrochloride 7-Methylamino-5-phenyl-6,7,8,9-tetrahydro(5H)benzocycloheptene hydrochloride AC1MIKMD LS-35171

Inchi
InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1
Canonical Smiles
CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)O
Isomers Smiles
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O
Properties
Melting Point
173 - 179 deg C
Computational chemical data
  • Molecular Weight:272.38196g/mol
  • Molecular Formula:C15H17NO4·CLH
  • XLogP3-AA:4
  • Exact Mass:272.17763
  • Monoisotopic Mass:272.17763
  • Complexity:382
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:40.5
  • Heavy Atom Count:20
  • Defined Atom Stereocenter Count:5
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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Recommended Suppliers
  • Tel:+ 91 79 65123395, 26463395
  • Fax:+ 91 79 26463395
  • Tel:571 85376369
  • Fax:571 88233092
 
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