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1243092-55-8 | 3-(3-methoxyisoxazol-5-yl)propanoyl chloride
CAS No: 1243092-55-8 Catalog No: AG00J6FJ MDL No:MFCD15732520
Product Description
Catalog Number:
AG00J6FJ
Chemical Name:
3-(3-methoxyisoxazol-5-yl)propanoyl chloride
CAS Number:
1243092-55-8
Molecular Formula:
C7H8ClNO3
Molecular Weight:
189.5963
MDL Number:
MFCD15732520
IUPAC Name:
3-(3-methoxy-1,2-oxazol-5-yl)propanoyl chloride
InChI:
InChI=1S/C7H8ClNO3/c1-11-7-4-5(12-9-7)2-3-6(8)10/h4H,2-3H2,1H3
InChI Key:
NPHNPOYGMCDCIT-UHFFFAOYSA-N
SMILES:
COc1cc(on1)CCC(=O)Cl
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.019g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.595g/mol
Monoisotopic Mass:
189.019g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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