Name: Name:methyl 4-(5-chlorothiophen-2-yl)-2,4-dioxobutanoate
Brand: Angene
SKU: AG019OGI
Rating: 90 (10 reviews)

methyl 4-(5-chlorothiophen-2-yl)-2,4-dioxobutanoate

CAS No.:

848178-49-4

Catalog Number:

AG019OGI

Molecular Formula:

C9H7ClO4S

Molecular Weight:

246.6675

Catalog Number:

AG019OGI

Chemical Name:

methyl 4-(5-chlorothiophen-2-yl)-2,4-dioxobutanoate

CAS Number:

848178-49-4

Molecular Formula:

C9H7ClO4S

Molecular Weight:

246.6675

MDL Number:

MFCD07324846

IUPAC Name:

methyl 4-(5-chlorothiophen-2-yl)-2,4-dioxobutanoate

InChI:

InChI=1S/C9H7ClO4S/c1-14-9(13)6(12)4-5(11)7-2-3-8(10)15-7/h2-3H,4H2,1H3

InChI Key:

PRBFOJLTYZLZGW-UHFFFAOYSA-N

SMILES:

COC(=O)C(=O)CC(=O)c1ccc(s1)Cl

Complexity:

292

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

245.975g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

246.661g/mol

Monoisotopic Mass:

245.975g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

88.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5