Home Carboxys 5-(aminomethyl)-2-methylfuran-3-carboxylic acid hydrochloride

5-(aminomethyl)-2-methylfuran-3-carboxylic acid hydrochloride

CAS No.:
1803592-68-8
Catalog Number:
AG01B7P3
Molecular Formula:
C7H10ClNO3
Molecular Weight:
191.6122
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Product Description
Catalog Number:
AG01B7P3
Chemical Name:
5-(aminomethyl)-2-methylfuran-3-carboxylic acid hydrochloride
CAS Number:
1803592-68-8
Molecular Formula:
C7H10ClNO3
Molecular Weight:
191.6122
MDL Number:
MFCD28145525
IUPAC Name:
5-(aminomethyl)-2-methylfuran-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C7H9NO3.ClH/c1-4-6(7(9)10)2-5(3-8)11-4;/h2H,3,8H2,1H3,(H,9,10);1H
InChI Key:
QYYLGEAAPQHFNE-UHFFFAOYSA-N
SMILES:
NCc1oc(c(c1)C(=O)O)C.Cl
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.035g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
191.611g/mol
Monoisotopic Mass:
191.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties