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144657-34-1 | 2(3H)-Naphthalenone, 4,4a,5,6-tetrahydro-8-methyl-
CAS No: 144657-34-1 Catalog No: AG001JYB MDL No:MFCD24706643
Product Description
Catalog Number:
AG001JYB
Chemical Name:
2(3H)-Naphthalenone, 4,4a,5,6-tetrahydro-8-methyl-
CAS Number:
144657-34-1
Molecular Formula:
C11H14O
Molecular Weight:
162.2283
MDL Number:
MFCD24706643
IUPAC Name:
8-methyl-4,4a,5,6-tetrahydro-3H-naphthalen-2-one
InChI:
InChI=1S/C11H14O/c1-8-3-2-4-9-5-6-10(12)7-11(8)9/h3,7,9H,2,4-6H2,1H3
InChI Key:
KHKQXXJNVPCSFK-UHFFFAOYSA-N
SMILES:
O=C1CCC2C(=C1)C(=CCC2)C
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.104g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.232g/mol
Monoisotopic Mass:
162.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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