200,000+ products from a single source!
sales@angenechem.com
160450-12-4 | Benzoic acid, 4-chloro-3-[[(1,1-dimethylethoxy)carbonyl]amino]-
CAS No: 160450-12-4 Catalog No: AG001RXA MDL No:MFCD02682162
Product Description
Catalog Number:
AG001RXA
Chemical Name:
Benzoic acid, 4-chloro-3-[[(1,1-dimethylethoxy)carbonyl]amino]-
CAS Number:
160450-12-4
Molecular Formula:
C12H14ClNO4
Molecular Weight:
271.6969
MDL Number:
MFCD02682162
IUPAC Name:
4-chloro-3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid
InChI:
InChI=1S/C12H14ClNO4/c1-12(2,3)18-11(17)14-9-6-7(10(15)16)4-5-8(9)13/h4-6H,1-3H3,(H,14,17)(H,15,16)
InChI Key:
ALVJRTBBSXWWQE-UHFFFAOYSA-N
SMILES:
O=C(Nc1cc(ccc1Cl)C(=O)O)OC(C)(C)C
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.061g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
271.697g/mol
Monoisotopic Mass:
271.061g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.