Home Other Building Blocks 2-[(5-methylthiophen-2-yl)formamido]acetic acid

2-[(5-methylthiophen-2-yl)formamido]acetic acid

CAS No.:
565166-71-4
Catalog Number:
AG019HMJ
Molecular Formula:
C8H9NO3S
Molecular Weight:
199.2270
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Product Description
Catalog Number:
AG019HMJ
Chemical Name:
2-[(5-methylthiophen-2-yl)formamido]acetic acid
CAS Number:
565166-71-4
Molecular Formula:
C8H9NO3S
Molecular Weight:
199.2270
MDL Number:
MFCD03966920
IUPAC Name:
2-[(5-methylthiophene-2-carbonyl)amino]acetic acid
InChI:
InChI=1S/C8H9NO3S/c1-5-2-3-6(13-5)8(12)9-4-7(10)11/h2-3H,4H2,1H3,(H,9,12)(H,10,11)
InChI Key:
ABACPIACDWJIOD-UHFFFAOYSA-N
SMILES:
Cc1ccc(s1)C(=O)NCC(=O)O
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.03g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
199.224g/mol
Monoisotopic Mass:
199.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
94.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties