Methyliminodiacetic acid - CAS 4408-64-4

Catalog:	BB025521
Product Name:	Methyliminodiacetic acid
CAS:	4408-64-4
Synonyms:	2-[carboxymethyl(methyl)amino]acetic acid

Technical Data

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Computed Properties

IUPAC Name:	2-[carboxymethyl(methyl)amino]acetic acid
Description:	Methyliminodiacetic acid (CAS# 4408-64-4) is a compound useful in organic synthesis.
Molecular Weight:	147.13
Molecular Formula:	C5H9NO4
Canonical SMILES:	CN(CC(=O)O)CC(=O)O
InChI:	InChI=1S/C5H9NO4/c1-6(2-4(7)8)3-5(9)10/h2-3H2,1H3,(H,7,8)(H,9,10)
InChI Key:	XWSGEVNYFYKXCP-UHFFFAOYSA-N
Boiling Point:	332.8 °C at 760 mmHg
Density:	1.367 g/cm³
Appearance:	White to yellow solid
MDL:	MFCD00004284
LogP:	-0.91260

Publication Number	Title	Priority Date
WO-2015193340-A1	A container particularly for local laundering purpose	20140618
US-2015360837-A1	Water soluble pouch comprising an embossed area	20140612
WO-2015189370-A1	Oxidation stable alpha-amylase variants	20140612
WO-2015191796-A1	Water soluble pouch comprising an embossed area	20140612
US-2015353858-A1	Hindered phenol compound, preparation thereof and use thereof as an antioxidant	20140605

PMID	Publication Date	Title	Journal
22917532	20120921	Quaterpyridine ligands for panchromatic Ru(II) dye sensitizers	The Journal of organic chemistry
22047083	20111216	Regioselective synthesis and slow-release Suzuki-Miyaura cross-coupling of MIDA boronate-functionalized isoxazoles and triazoles	The Journal of organic chemistry
21726770	20110801	Molecular recognition patterns of 2-aminopurine versus adenine: a view through ternary copper(II) complexes	Journal of inorganic biochemistry
21557585	20110623	Vibrational spectroscopy of N-methyliminodiacetic acid (MIDA)-protected boronate ester: examination of the B-N dative bond	The journal of physical chemistry. A
21526832	20110617	One-pot reductive amination and Suzuki-Miyaura cross-coupling of formyl aryl and heteroaryl MIDA boronates in array format	The Journal of organic chemistry

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[87-88-7]
Chloranilic acid
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	129
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	147.05315777
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	147.05315777
Rotatable Bond Count:	4
Topological Polar Surface Area:	77.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-3.3