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6454-84-8 | 4-METHYLISOXAZOLE
CAS No: 6454-84-8 Catalog No: AG00EDCT MDL No:MFCD04118106
Product Description
Catalog Number:
AG00EDCT
Chemical Name:
4-METHYLISOXAZOLE
CAS Number:
6454-84-8
Molecular Formula:
C4H5NO
Molecular Weight:
83.0886
MDL Number:
MFCD04118106
IUPAC Name:
4-methyl-1,2-oxazole
InChI:
InChI=1S/C4H5NO/c1-4-2-5-6-3-4/h2-3H,1H3
InChI Key:
VHWFNFITHSPBSR-UHFFFAOYSA-N
SMILES:
Cc1conc1
Properties
Complexity:
46.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
83.037g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
83.09g/mol
Monoisotopic Mass:
83.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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