Home Aminos 2-(aminomethyl)-2-methylbutanedioic acid hydrochloride

2-(aminomethyl)-2-methylbutanedioic acid hydrochloride

CAS No.:
86970-16-3
Catalog Number:
AG00VVO7
Molecular Formula:
C6H12ClNO4
Molecular Weight:
197.6168
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Product Description
Catalog Number:
AG00VVO7
Chemical Name:
2-(aminomethyl)-2-methylbutanedioic acid hydrochloride
CAS Number:
86970-16-3
Molecular Formula:
C6H12ClNO4
Molecular Weight:
197.6168
MDL Number:
MFCD11041094
IUPAC Name:
2-(aminomethyl)-2-methylbutanedioic acid;hydrochloride
InChI:
InChI=1S/C6H11NO4.ClH/c1-6(3-7,5(10)11)2-4(8)9;/h2-3,7H2,1H3,(H,8,9)(H,10,11);1H
InChI Key:
QDBXAOKMEBAGTL-UHFFFAOYSA-N
SMILES:
NCC(C(=O)O)(CC(=O)O)C.Cl
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.045g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
197.615g/mol
Monoisotopic Mass:
197.045g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties