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7693-45-0 | 4-Chlorophenyl carbonochloridate
CAS No: 7693-45-0 Catalog No: AG003L7T MDL No:MFCD00000638
Product Description
Catalog Number:
AG003L7T
Chemical Name:
4-Chlorophenyl carbonochloridate
CAS Number:
7693-45-0
Molecular Formula:
C7H4Cl2O2
Molecular Weight:
191.0115
MDL Number:
MFCD00000638
IUPAC Name:
(4-chlorophenyl) carbonochloridate
InChI:
InChI=1S/C7H4Cl2O2/c8-5-1-3-6(4-2-5)11-7(9)10/h1-4H
InChI Key:
RYWGPCLTVXMMHO-UHFFFAOYSA-N
SMILES:
ClC(=O)Oc1ccc(cc1)Cl
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.959g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.007g/mol
Monoisotopic Mass:
189.959g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| E. coli histidine triad nucleotide binding protein 1 (ecHinT) is a catalytic regulator of D-alanine dehydrogenase (DadA) activity in vivo. | PloS one 20110101 |
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