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88020-86-4 | 1H-Indene-2-propanoic acid, 2,3-dihydro-
CAS No: 88020-86-4 Catalog No: AG004JM6 MDL No:MFCD20639202
Product Description
Catalog Number:
AG004JM6
Chemical Name:
1H-Indene-2-propanoic acid, 2,3-dihydro-
CAS Number:
88020-86-4
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
MDL Number:
MFCD20639202
IUPAC Name:
3-(2,3-dihydro-1H-inden-2-yl)propanoic acid
InChI:
InChI=1S/C12H14O2/c13-12(14)6-5-9-7-10-3-1-2-4-11(10)8-9/h1-4,9H,5-8H2,(H,13,14)
InChI Key:
JZBNSIMTJHPGGP-UHFFFAOYSA-N
SMILES:
OC(=O)CCC1Cc2c(C1)cccc2
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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