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20133-94-2 | 2-Propanol, 1-chloro-3-(2-naphthalenyloxy)-
CAS No: 20133-94-2 Catalog No: AG002DCI MDL No:
Product Description
Catalog Number:
AG002DCI
Chemical Name:
2-Propanol, 1-chloro-3-(2-naphthalenyloxy)-
CAS Number:
20133-94-2
Molecular Formula:
C13H13ClO2
Molecular Weight:
236.6941
IUPAC Name:
1-chloro-3-naphthalen-2-yloxypropan-2-ol
InChI:
InChI=1S/C13H13ClO2/c14-8-12(15)9-16-13-6-5-10-3-1-2-4-11(10)7-13/h1-7,12,15H,8-9H2
InChI Key:
VGAVBNYEEHMTOL-UHFFFAOYSA-N
SMILES:
ClCC(COc1ccc2c(c1)cccc2)O
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.06g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.695g/mol
Monoisotopic Mass:
236.06g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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