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7480-19-5 | Carbamic acid, (2-iodo-1-methyl-1-phenylethyl)-, methyl ester
CAS No: 7480-19-5 Catalog No: AG00598K MDL No:
Product Description
Catalog Number:
AG00598K
Chemical Name:
Carbamic acid, (2-iodo-1-methyl-1-phenylethyl)-, methyl ester
CAS Number:
7480-19-5
Molecular Formula:
C11H14INO2
Molecular Weight:
319.1388
IUPAC Name:
methyl N-(1-iodo-2-phenylpropan-2-yl)carbamate
InChI:
InChI=1S/C11H14INO2/c1-11(8-12,13-10(14)15-2)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,13,14)
InChI Key:
GAHWJNMDNYLDGP-UHFFFAOYSA-N
SMILES:
ICC(c1ccccc1)(NC(=O)OC)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.007g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
319.142g/mol
Monoisotopic Mass:
319.007g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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