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136995-29-4 | 4-Isoxazolecarbonyl chloride, 5-phenyl- (9CI)
CAS No: 136995-29-4 Catalog No: AG00AIHF MDL No:
Product Description
Catalog Number:
AG00AIHF
Chemical Name:
4-Isoxazolecarbonyl chloride, 5-phenyl- (9CI)
CAS Number:
136995-29-4
IUPAC Name:
5-phenyl-1,2-oxazole-4-carbonyl chloride
InChI:
InChI=1S/C10H6ClNO2/c11-10(13)8-6-12-14-9(8)7-4-2-1-3-5-7/h1-6H
InChI Key:
GRCVQCCYLUGKPI-UHFFFAOYSA-N
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.009g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.613g/mol
Monoisotopic Mass:
207.009g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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