Home Halogens 1-(5-chlorothiophene-2-carbonyl)pyrrolidine-2-carboxylic acid

1-(5-chlorothiophene-2-carbonyl)pyrrolidine-2-carboxylic acid

CAS No.:
351493-11-3
Catalog Number:
AG01EKB6
Molecular Formula:
C10H10ClNO3S
Molecular Weight:
259.7093
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Product Description
Catalog Number:
AG01EKB6
Chemical Name:
1-(5-chlorothiophene-2-carbonyl)pyrrolidine-2-carboxylic acid
CAS Number:
351493-11-3
Molecular Formula:
C10H10ClNO3S
Molecular Weight:
259.7093
MDL Number:
MFCD11646896
IUPAC Name:
1-(5-chlorothiophene-2-carbonyl)pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C10H10ClNO3S/c11-8-4-3-7(16-8)9(13)12-5-1-2-6(12)10(14)15/h3-4,6H,1-2,5H2,(H,14,15)
InChI Key:
TVIXLMZTSWAKCN-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCCN1C(=O)c1ccc(s1)Cl
Properties
Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.007g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.704g/mol
Monoisotopic Mass:
259.007g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties