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114476-85-6 | Acetyl chloride, 2-[2-(aminocarbonyl)phenoxy]-
CAS No: 114476-85-6 Catalog No: AG000EH7 MDL No:
Product Description
Catalog Number:
AG000EH7
Chemical Name:
Acetyl chloride, 2-[2-(aminocarbonyl)phenoxy]-
CAS Number:
114476-85-6
Molecular Formula:
C9H8ClNO3
Molecular Weight:
213.6177
IUPAC Name:
2-(2-carbamoylphenoxy)acetyl chloride
InChI:
InChI=1S/C9H8ClNO3/c10-8(12)5-14-7-4-2-1-3-6(7)9(11)13/h1-4H,5H2,(H2,11,13)
InChI Key:
LOTGWLKDQWRLME-UHFFFAOYSA-N
SMILES:
ClC(=O)COc1ccccc1C(=O)N
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.019g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.617g/mol
Monoisotopic Mass:
213.019g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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