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20861-99-8 | Oxirane, 2-(2-naphthalenyl)-
CAS No: 20861-99-8 Catalog No: AG002JTI MDL No:MFCD01712738
Product Description
Catalog Number:
AG002JTI
Chemical Name:
Oxirane, 2-(2-naphthalenyl)-
CAS Number:
20861-99-8
Molecular Formula:
C12H10O
Molecular Weight:
170.2072
MDL Number:
MFCD01712738
IUPAC Name:
2-naphthalen-2-yloxirane
InChI:
InChI=1S/C12H10O/c1-2-4-10-7-11(12-8-13-12)6-5-9(10)3-1/h1-7,12H,8H2
InChI Key:
LAGFFQGUWPDQNH-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)cc(cc2)C1CO1
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.073g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.211g/mol
Monoisotopic Mass:
170.073g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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