200,000+ products from a single source!
sales@angenechem.com
149524-63-0 | Pentanedioic acid, 2-(bromomethylene)-, 1,5-dimethyl ester, (2E)-
CAS No: 149524-63-0 Catalog No: AG001LT1 MDL No:
Product Description
Catalog Number:
AG001LT1
Chemical Name:
Pentanedioic acid, 2-(bromomethylene)-, 1,5-dimethyl ester, (2E)-
CAS Number:
149524-63-0
Molecular Formula:
C8H11BrO4
Molecular Weight:
251.0745
IUPAC Name:
dimethyl 2-(bromomethylidene)pentanedioate
InChI:
InChI=1S/C8H11BrO4/c1-12-7(10)4-3-6(5-9)8(11)13-2/h5H,3-4H2,1-2H3
InChI Key:
JBZLMLFYOAYMTI-UHFFFAOYSA-N
SMILES:
COC(=O)CC/C(=C\Br)/C(=O)OC
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.984g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.076g/mol
Monoisotopic Mass:
249.984g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.