200,000+ products from a single source!
sales@angenechem.com
86004-64-0 | 2-((4-BROMO-3-THIENYL)THIO)PROPANOIC ACID
CAS No: 86004-64-0 Catalog No: AG004M5T MDL No:
Product Description
Catalog Number:
AG004M5T
Chemical Name:
2-((4-BROMO-3-THIENYL)THIO)PROPANOIC ACID
CAS Number:
86004-64-0
Molecular Formula:
C7H7BrO2S2
Molecular Weight:
267.1633
IUPAC Name:
2-(4-bromothiophen-3-yl)sulfanylpropanoic acid
InChI:
InChI=1S/C7H7BrO2S2/c1-4(7(9)10)12-6-3-11-2-5(6)8/h2-4H,1H3,(H,9,10)
InChI Key:
DMJZWFZICOEEAJ-UHFFFAOYSA-N
SMILES:
CC(C(=O)O)Sc1cscc1Br
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.907g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.155g/mol
Monoisotopic Mass:
265.907g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
90.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.