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113388-12-8 | Naphthalene, 1,2,5,6,7,8-hexahydro-1,1,6-trimethyl-, (R)- (9CI)
CAS No: 113388-12-8 Catalog No: AG0008DL MDL No:
Product Description
Catalog Number:
AG0008DL
Chemical Name:
Naphthalene, 1,2,5,6,7,8-hexahydro-1,1,6-trimethyl-, (R)- (9CI)
CAS Number:
113388-12-8
Molecular Formula:
C13H20
Molecular Weight:
176.2979
IUPAC Name:
2,5,5-trimethyl-2,3,4,6-tetrahydro-1H-naphthalene
InChI:
InChI=1S/C13H20/c1-10-6-7-12-11(9-10)5-4-8-13(12,2)3/h4-5,10H,6-9H2,1-3H3
InChI Key:
ZVLCEYSKHWNJOH-UHFFFAOYSA-N
SMILES:
C[C@@H]1CCC2=C(C1)C=CCC2(C)C
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.157g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.303g/mol
Monoisotopic Mass:
176.157g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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