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709674-68-0 | (dimethyl-1,3-oxazol-2-yl)methanol
CAS No: 709674-68-0 Catalog No: AG019Z37 MDL No:MFCD16989244
Product Description
Catalog Number:
AG019Z37
Chemical Name:
(dimethyl-1,3-oxazol-2-yl)methanol
CAS Number:
709674-68-0
Molecular Formula:
C6H9NO2
Molecular Weight:
127.1412
MDL Number:
MFCD16989244
IUPAC Name:
(4,5-dimethyl-1,3-oxazol-2-yl)methanol
InChI:
InChI=1S/C6H9NO2/c1-4-5(2)9-6(3-8)7-4/h8H,3H2,1-2H3
InChI Key:
LUWGQGKWKMWQLD-UHFFFAOYSA-N
SMILES:
OCc1oc(c(n1)C)C
Properties
Complexity:
97.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.063g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
127.143g/mol
Monoisotopic Mass:
127.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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