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212063-20-2 | Carbamic acid, (2-iodo-4-methylphenyl)-, phenylmethyl ester
CAS No: 212063-20-2 Catalog No: AG006YL3 MDL No:
Product Description
Catalog Number:
AG006YL3
Chemical Name:
Carbamic acid, (2-iodo-4-methylphenyl)-, phenylmethyl ester
CAS Number:
212063-20-2
Molecular Formula:
C15H14INO2
Molecular Weight:
367.1816
IUPAC Name:
benzyl N-(2-iodo-4-methylphenyl)carbamate
InChI:
InChI=1S/C15H14INO2/c1-11-7-8-14(13(16)9-11)17-15(18)19-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,18)
InChI Key:
UCSYWNCZFPBHIB-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1I)C)OCc1ccccc1
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.007g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
367.186g/mol
Monoisotopic Mass:
367.007g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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