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61533-67-3 | 1-(1,3-benzoxazol-2-yl)ethanol
CAS No: 61533-67-3 Catalog No: AG00F4UY MDL No:MFCD00224019
Product Description
Catalog Number:
AG00F4UY
Chemical Name:
1-(1,3-benzoxazol-2-yl)ethanol
CAS Number:
61533-67-3
Molecular Formula:
C9H9NO2
Molecular Weight:
163.1733
MDL Number:
MFCD00224019
IUPAC Name:
1-(1,3-benzoxazol-2-yl)ethanol
InChI:
InChI=1S/C9H9NO2/c1-6(11)9-10-7-4-2-3-5-8(7)12-9/h2-6,11H,1H3
InChI Key:
VWZPVYDIHHKSEE-UHFFFAOYSA-N
SMILES:
CC(c1nc2c(o1)cccc2)O
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.176g/mol
Monoisotopic Mass:
163.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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