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148624-14-0 | 1-Naphthalenol, 3,4-dihydro-2-methyl-, 1-acetate
CAS No: 148624-14-0 Catalog No: AG001L3I MDL No:
Product Description
Catalog Number:
AG001L3I
Chemical Name:
1-Naphthalenol, 3,4-dihydro-2-methyl-, 1-acetate
CAS Number:
148624-14-0
Molecular Formula:
C13H14O2
Molecular Weight:
202.2491
IUPAC Name:
acetic acid;2-methyl-3,4-dihydronaphthalen-1-ol
InChI:
InChI=1S/C11H12O.C2H4O2/c1-8-6-7-9-4-2-3-5-10(9)11(8)12;1-2(3)4/h2-5,12H,6-7H2,1H3;1H3,(H,3,4)
InChI Key:
OFKXYCRHEHBDKF-UHFFFAOYSA-N
SMILES:
CC(=O)OC1=C(C)CCc2c1cccc2
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.11g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.268g/mol
Monoisotopic Mass:
220.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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