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92863-11-1 | 3,8,8-trimethyl-5,6,7,8-tetrahydronaphthalene-2-carbaldehyde
CAS No: 92863-11-1 Catalog No: AG0068A4 MDL No:
Product Description
Catalog Number:
AG0068A4
Chemical Name:
3,8,8-trimethyl-5,6,7,8-tetrahydronaphthalene-2-carbaldehyde
CAS Number:
92863-11-1
Molecular Formula:
C14H18O
Molecular Weight:
202.2921
IUPAC Name:
3,8,8-trimethyl-6,7-dihydro-5H-naphthalene-2-carbaldehyde
InChI:
InChI=1S/C14H18O/c1-10-7-11-5-4-6-14(2,3)13(11)8-12(10)9-15/h7-9H,4-6H2,1-3H3
InChI Key:
KTPBKTARRQKWBB-UHFFFAOYSA-N
SMILES:
O=Cc1cc2c(cc1C)CCCC2(C)C
NSC Number:
16804
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.297g/mol
Monoisotopic Mass:
202.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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