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Home > Other Heterocycles > 87923-23-7
87923-23-7 | Bicyclo[4.2.0]octa-3,7-diene, 1,7-dimethyl-8-phenyl-, cis-
CAS No: 87923-23-7 Catalog No: AG004FEP MDL No:
Product Description
Catalog Number:
AG004FEP
Chemical Name:
Bicyclo[4.2.0]octa-3,7-diene, 1,7-dimethyl-8-phenyl-, cis-
CAS Number:
87923-23-7
Molecular Formula:
C16H18
Molecular Weight:
210.3141
IUPAC Name:
(1S,6S)-1,7-dimethyl-8-phenylbicyclo[4.2.0]octa-3,7-diene
InChI:
InChI=1S/C16H18/c1-12-14-10-6-7-11-16(14,2)15(12)13-8-4-3-5-9-13/h3-9,14H,10-11H2,1-2H3/t14-,16-/m0/s1
InChI Key:
SAEMLFGYEUACQX-HOCLYGCPSA-N
SMILES:
CC1=C([C@@]2([C@H]1CC=CC2)C)c1ccccc1
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
210.141g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.32g/mol
Monoisotopic Mass:
210.141g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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