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88632-94-4 | 1H-Indene-4-carboxaldehyde, 2,3-dihydro-5,6,7-trimethyl-
CAS No: 88632-94-4 Catalog No: AG004BHB MDL No:
Product Description
Catalog Number:
AG004BHB
Chemical Name:
1H-Indene-4-carboxaldehyde, 2,3-dihydro-5,6,7-trimethyl-
CAS Number:
88632-94-4
Molecular Formula:
C13H16O
Molecular Weight:
188.2655
IUPAC Name:
5,6,7-trimethyl-2,3-dihydro-1H-indene-4-carbaldehyde
InChI:
InChI=1S/C13H16O/c1-8-9(2)11-5-4-6-12(11)13(7-14)10(8)3/h7H,4-6H2,1-3H3
InChI Key:
DWALVTAGNMLRAM-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)c(C)c(c2c1CCC2)C
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.12g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.27g/mol
Monoisotopic Mass:
188.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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