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116325-90-7 | Cyclopenta[c][2]benzopyran, decahydro-6,6,7,8,8,9b-hexamethyl-
CAS No: 116325-90-7 Catalog No: AG000C7F MDL No:
Product Description
Catalog Number:
AG000C7F
Chemical Name:
Cyclopenta[c][2]benzopyran, decahydro-6,6,7,8,8,9b-hexamethyl-
CAS Number:
116325-90-7
Molecular Formula:
C18H32O
Molecular Weight:
264.4461
IUPAC Name:
6,6,7,8,8,9b-hexamethyl-2,3,3a,5,5a,7,9,9a-octahydro-1H-cyclopenta[c]isochromene
InChI:
InChI=1S/C18H32O/c1-12-16(2,3)10-13-14(17(12,4)5)11-19-15-8-7-9-18(13,15)6/h12-15H,7-11H2,1-6H3
InChI Key:
ZWUNKGXSVYJTMM-UHFFFAOYSA-N
SMILES:
CC1C(C)(C)CC2C(C1(C)C)COC1C2(C)CCC1
Properties
Complexity:
370
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.245g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.453g/mol
Monoisotopic Mass:
264.245g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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