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39499-34-8 | 5-METHYLISOXAZOLE-3-CARBONYL CHLORIDE
CAS No: 39499-34-8 Catalog No: AG00BZHV MDL No:MFCD00085127
Product Description
Catalog Number:
AG00BZHV
Chemical Name:
5-METHYLISOXAZOLE-3-CARBONYL CHLORIDE
CAS Number:
39499-34-8
Molecular Formula:
C5H4ClNO2
Molecular Weight:
145.5438
MDL Number:
MFCD00085127
IUPAC Name:
5-methyl-1,2-oxazole-3-carbonyl chloride
InChI:
InChI=1S/C5H4ClNO2/c1-3-2-4(5(6)8)7-9-3/h2H,1H3
InChI Key:
XMVNMWDLOGSUSM-UHFFFAOYSA-N
SMILES:
Cc1cc(no1)C(=O)Cl
EC Number:
254-475-6
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.993g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.542g/mol
Monoisotopic Mass:
144.993g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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