2,2'-(Methylazanediyl)diacetic acid

Catalog Number	ACM4408644-1
CAS	4408-64-4
Structure
Synonyms	N-Methyliminodiacetic acid; Methyliminodiacetic acid
IUPAC Name	2-[carboxymethyl(methyl)amino]acetic acid
Molecular Weight	147.13
Molecular Formula	C5H9NO4
Canonical SMILES	CN(CC(=O)O)CC(=O)O
InChI	XWSGEVNYFYKXCP-UHFFFAOYSA-N
InChI Key	InChI=1S/C5H9NO4/c1-6(2-4(7)8)3-5(9)10/h2-3H2,1H3,(H,7,8)(H,9,10)
Boiling Point	332.8 °C at 760 mmHg
Melting Point	220 °C (dec.)-lit.
Purity	98%
Appearance	White to cream powder
Complexity	129
Covalently-Bonded Unit Count	1
EC Number	224-557-6
Exact Mass	147.05315777
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Monoisotopic Mass	147.05315777
Rotatable Bond Count	4
Topological Polar Surface Area	77.8 Ų