200,000+ products from a single source!
sales@angenechem.com
190071-23-9 | Benzoic acid, 4-(acetylamino)-3-iodo-, methyl ester
CAS No: 190071-23-9 Catalog No: AG002EAH MDL No:MFCD09998274
Product Description
Catalog Number:
AG002EAH
Chemical Name:
Benzoic acid, 4-(acetylamino)-3-iodo-, methyl ester
CAS Number:
190071-23-9
Molecular Formula:
C10H10INO3
Molecular Weight:
319.0958
MDL Number:
MFCD09998274
IUPAC Name:
methyl 4-acetamido-3-iodobenzoate
InChI:
InChI=1S/C10H10INO3/c1-6(13)12-9-4-3-7(5-8(9)11)10(14)15-2/h3-5H,1-2H3,(H,12,13)
InChI Key:
XWTQNEZTXKVCML-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)I)NC(=O)C
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.971g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
319.098g/mol
Monoisotopic Mass:
318.971g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.