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Home > Other Heterocycles > 87923-83-9
87923-83-9 | Bicyclo[4.2.0]octa-3,7-diene, 7,8-dimethyl-1-phenyl-, cis-
CAS No: 87923-83-9 Catalog No: AG004FEO MDL No:
Product Description
Catalog Number:
AG004FEO
Chemical Name:
Bicyclo[4.2.0]octa-3,7-diene, 7,8-dimethyl-1-phenyl-, cis-
CAS Number:
87923-83-9
Molecular Formula:
C16H18
Molecular Weight:
210.3141
IUPAC Name:
(1S,6S)-7,8-dimethyl-1-phenylbicyclo[4.2.0]octa-3,7-diene
InChI:
InChI=1S/C16H18/c1-12-13(2)16(11-7-6-10-15(12)16)14-8-4-3-5-9-14/h3-9,15H,10-11H2,1-2H3/t15-,16+/m0/s1
InChI Key:
UFFUMVPZGAYMOF-JKSUJKDBSA-N
SMILES:
CC1=C(C)[C@H]2[C@@]1(CC=CC2)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:
3.6
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