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18096-67-8 | 1H-Indene-2-methanol, 2,3-dihydro-, 2-acetate
CAS No: 18096-67-8 Catalog No: AG0022HF MDL No:
Product Description
Catalog Number:
AG0022HF
Chemical Name:
1H-Indene-2-methanol, 2,3-dihydro-, 2-acetate
CAS Number:
18096-67-8
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
IUPAC Name:
acetic acid;2,3-dihydro-1H-inden-2-ylmethanol
InChI:
InChI=1S/C10H12O.C2H4O2/c11-7-8-5-9-3-1-2-4-10(9)6-8;1-2(3)4/h1-4,8,11H,5-7H2;1H3,(H,3,4)
InChI Key:
FDWPJGFVPIHJDL-UHFFFAOYSA-N
SMILES:
CC(=O)OCC1Cc2c(C1)cccc2
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.11g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
208.257g/mol
Monoisotopic Mass:
208.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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