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1306763-24-5 | 1H-Indene-4-carbonitrile, 2,3-dihydro-1-hydroxy-, (1R)-
CAS No: 1306763-24-5 Catalog No: AG000USK MDL No:
Product Description
Catalog Number:
AG000USK
Chemical Name:
1H-Indene-4-carbonitrile, 2,3-dihydro-1-hydroxy-, (1R)-
CAS Number:
1306763-24-5
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
IUPAC Name:
(1R)-1-hydroxy-2,3-dihydro-1H-indene-4-carbonitrile
InChI:
InChI=1S/C10H9NO/c11-6-7-2-1-3-9-8(7)4-5-10(9)12/h1-3,10,12H,4-5H2/t10-/m1/s1
InChI Key:
MEFZMTYUOQFQHF-SNVBAGLBSA-N
SMILES:
N#Cc1cccc2c1CC[C@H]2O
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
159.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.188g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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