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Home Carboxys 5-(Aminomethyl)furan-2-carboxylic acid hydrochloride

5-(Aminomethyl)furan-2-carboxylic acid hydrochloride

CAS No.:
51521-95-0
Catalog Number:
AG00J3FU
Molecular Formula:
C6H8ClNO3
Molecular Weight:
177.5856
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$289
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Product Description
Catalog Number:
AG00J3FU
Chemical Name:
5-(Aminomethyl)furan-2-carboxylic acid hydrochloride
CAS Number:
51521-95-0
Molecular Formula:
C6H8ClNO3
Molecular Weight:
177.5856
MDL Number:
MFCD20731136
IUPAC Name:
5-(aminomethyl)furan-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C6H7NO3.ClH/c7-3-4-1-2-5(10-4)6(8)9;/h1-2H,3,7H2,(H,8,9);1H
InChI Key:
VZBDETJVJSTWPP-UHFFFAOYSA-N
SMILES:
NCc1ccc(o1)C(=O)O.Cl
Properties
Complexity:
137  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.019g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
177.584g/mol
Monoisotopic Mass:
177.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Synthesis and evaluation of novel heteroaromatic substrates of GABA aminotransferase. Bioorganic & medicinal chemistry 20121001
Properties