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854015-61-5 | (4-IODO-5-METHYL-1,2-OXAZOL-3-YL)METHANOL
CAS No: 854015-61-5 Catalog No: AG00G96A MDL No:MFCD20484840
Product Description
Catalog Number:
AG00G96A
Chemical Name:
(4-IODO-5-METHYL-1,2-OXAZOL-3-YL)METHANOL
CAS Number:
854015-61-5
Molecular Formula:
C5H6INO2
Molecular Weight:
239.0111
MDL Number:
MFCD20484840
IUPAC Name:
(4-iodo-5-methyl-1,2-oxazol-3-yl)methanol
InChI:
InChI=1S/C5H6INO2/c1-3-5(6)4(2-8)7-9-3/h8H,2H2,1H3
InChI Key:
DNXUUFMHWSRECW-UHFFFAOYSA-N
SMILES:
OCc1noc(c1I)C
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.944g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.012g/mol
Monoisotopic Mass:
238.944g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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