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828913-71-9 | 1H-Inden-2-ol, 2,3-dihydro-1-(1-phenylethylidene)-
CAS No: 828913-71-9 Catalog No: AG004WEU MDL No:
Product Description
Catalog Number:
AG004WEU
Chemical Name:
1H-Inden-2-ol, 2,3-dihydro-1-(1-phenylethylidene)-
CAS Number:
828913-71-9
Molecular Formula:
C17H16O
Molecular Weight:
236.3083
IUPAC Name:
3-(1-phenylethylidene)-1,2-dihydroinden-2-ol
InChI:
InChI=1S/C17H16O/c1-12(13-7-3-2-4-8-13)17-15-10-6-5-9-14(15)11-16(17)18/h2-10,16,18H,11H2,1H3
InChI Key:
CTSRCSFPBSHCNY-UHFFFAOYSA-N
SMILES:
OC1Cc2c(C1=C(c1ccccc1)C)cccc2
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.12g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.314g/mol
Monoisotopic Mass:
236.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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