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141580-65-6 | Carbonic acid, (phenoxycarbonyl)azanyl phenyl ester
CAS No: 141580-65-6 Catalog No: AG001GM5 MDL No:
Product Description
Catalog Number:
AG001GM5
Chemical Name:
Carbonic acid, (phenoxycarbonyl)azanyl phenyl ester
CAS Number:
141580-65-6
Molecular Formula:
C14H11NO5
Molecular Weight:
273.2408
IUPAC Name:
(phenoxycarbonylamino) phenyl carbonate
InChI:
InChI=1S/C14H11NO5/c16-13(18-11-7-3-1-4-8-11)15-20-14(17)19-12-9-5-2-6-10-12/h1-10H,(H,15,16)
InChI Key:
PTZVLZBVOIUMCH-UHFFFAOYSA-N
SMILES:
O=C(Oc1ccccc1)ONC(=O)Oc1ccccc1
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.064g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.244g/mol
Monoisotopic Mass:
273.064g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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