200,000+ products from a single source!
sales@angenechem.com
1353946-00-5 | [(2-Iodo-benzyl)-isopropyl-amino]-acetic acid
CAS No: 1353946-00-5 Catalog No: AG01FAB5 MDL No:
Product Description
Catalog Number:
AG01FAB5
Chemical Name:
[(2-Iodo-benzyl)-isopropyl-amino]-acetic acid
CAS Number:
1353946-00-5
Molecular Formula:
C12H16INO2
Molecular Weight:
333.1654
IUPAC Name:
2-[(2-iodophenyl)methyl-propan-2-ylamino]acetic acid
InChI:
InChI=1S/C12H16INO2/c1-9(2)14(8-12(15)16)7-10-5-3-4-6-11(10)13/h3-6,9H,7-8H2,1-2H3,(H,15,16)
InChI Key:
WHXWJIOENZMIGU-UHFFFAOYSA-N
SMILES:
OC(=O)CN(C(C)C)Cc1ccccc1I
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.023g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
333.169g/mol
Monoisotopic Mass:
333.023g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.