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35166-36-0 | 3-METHOXY-5-HYDROXYMETHYLISOXAZOLE
CAS No: 35166-36-0 Catalog No: AG00CM45 MDL No:MFCD25962612
Product Description
Catalog Number:
AG00CM45
Chemical Name:
3-METHOXY-5-HYDROXYMETHYLISOXAZOLE
CAS Number:
35166-36-0
Molecular Formula:
C5H7NO3
Molecular Weight:
129.1140
MDL Number:
MFCD25962612
IUPAC Name:
(3-methoxy-1,2-oxazol-5-yl)methanol
InChI:
InChI=1S/C5H7NO3/c1-8-5-2-4(3-7)9-6-5/h2,7H,3H2,1H3
InChI Key:
DIIVXOUBNHJXED-UHFFFAOYSA-N
SMILES:
COc1noc(c1)CO
Properties
Complexity:
88.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.043g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
129.115g/mol
Monoisotopic Mass:
129.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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