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115008-49-6 | Carbamic acid, (3,5-dichlorophenyl)-, 3-iodo-2-propynyl ester (9CI)
CAS No: 115008-49-6 Catalog No: AG000FKZ MDL No:
Product Description
Catalog Number:
AG000FKZ
Chemical Name:
Carbamic acid, (3,5-dichlorophenyl)-, 3-iodo-2-propynyl ester (9CI)
CAS Number:
115008-49-6
Molecular Formula:
C10H6Cl2INO2
Molecular Weight:
369.9706
IUPAC Name:
3-iodoprop-2-ynyl N-(3,5-dichlorophenyl)carbamate
InChI:
InChI=1S/C10H6Cl2INO2/c11-7-4-8(12)6-9(5-7)14-10(15)16-3-1-2-13/h4-6H,3H2,(H,14,15)
InChI Key:
ONKOGJFTAKIIAG-UHFFFAOYSA-N
SMILES:
IC#CCOC(=O)Nc1cc(Cl)cc(c1)Cl
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.882g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
369.967g/mol
Monoisotopic Mass:
368.882g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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