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879-33-4 | 1H-Indene, 2,3-dihydro-5-methyl-1-(1-methylethyl)-
CAS No: 879-33-4 Catalog No: AG004DNH MDL No:
Product Description
Catalog Number:
AG004DNH
Chemical Name:
1H-Indene, 2,3-dihydro-5-methyl-1-(1-methylethyl)-
CAS Number:
879-33-4
Molecular Formula:
C13H18
Molecular Weight:
174.2820
IUPAC Name:
5-methyl-1-propan-2-yl-2,3-dihydro-1H-indene
InChI:
InChI=1S/C13H18/c1-9(2)12-7-5-11-8-10(3)4-6-13(11)12/h4,6,8-9,12H,5,7H2,1-3H3
InChI Key:
HIIBPAXYRRQHPW-UHFFFAOYSA-N
SMILES:
CC(C1CCc2c1ccc(c2)C)C
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.141g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.287g/mol
Monoisotopic Mass:
174.141g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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