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21123-19-3 | Phenol, 3-methoxy-, 1-(N-phenylcarbamate)
CAS No: 21123-19-3 Catalog No: AG002L8J MDL No:
Product Description
Catalog Number:
AG002L8J
Chemical Name:
Phenol, 3-methoxy-, 1-(N-phenylcarbamate)
CAS Number:
21123-19-3
Molecular Formula:
C14H13NO3
Molecular Weight:
243.2579
IUPAC Name:
(3-methoxyphenyl) N-phenylcarbamate
InChI:
InChI=1S/C14H13NO3/c1-17-12-8-5-9-13(10-12)18-14(16)15-11-6-3-2-4-7-11/h2-10H,1H3,(H,15,16)
InChI Key:
VUQBKMUXPJXMQT-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)OC(=O)Nc1ccccc1
NSC Number:
136974
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.262g/mol
Monoisotopic Mass:
243.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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