Home Carboxys 5-(piperazin-1-ylmethyl)thiophene-2-carboxylic acid dihydrochloride

5-(piperazin-1-ylmethyl)thiophene-2-carboxylic acid dihydrochloride

CAS No.:
1797717-71-5
Catalog Number:
AG01AXKD
Molecular Formula:
C10H16Cl2N2O2S
Molecular Weight:
299.2172
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Product Description
Catalog Number:
AG01AXKD
Chemical Name:
5-(piperazin-1-ylmethyl)thiophene-2-carboxylic acid dihydrochloride
CAS Number:
1797717-71-5
Molecular Formula:
C10H16Cl2N2O2S
Molecular Weight:
299.2172
MDL Number:
MFCD27959468
IUPAC Name:
5-(piperazin-1-ylmethyl)thiophene-2-carboxylic acid;dihydrochloride
InChI:
InChI=1S/C10H14N2O2S.2ClH/c13-10(14)9-2-1-8(15-9)7-12-5-3-11-4-6-12;;/h1-2,11H,3-7H2,(H,13,14);2*1H
InChI Key:
ATSZTAVJSNXSGE-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(s1)CN1CCNCC1.Cl.Cl
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.031g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
299.21g/mol
Monoisotopic Mass:
298.031g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties