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Product No: AW1261

N,N-Dimethylglycine, >98.0%(T)

Name: N,N-Dimethylglycine
Brand: Chempure

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CAS Number

1118-68-9

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About this item

IUPAC name	2-(dimethylamino)acetic acid
canonical smiles	CN(C)CC(=O)O
inchi	InChI=1S/C4H9NO2/c1-5(2)3-4(6)7/h3H2,1-2H3,(H,6,7)
inchi key	FFDGPVCHZBVARC-UHFFFAOYSA-N
molecular formula	C4H9NO2
synonyms	N,N-dimethylglycine 1118-68-9 dimethylglycine 2-(dimethylamino)acetic acid (Dimethylamino)acetic acid
Compound Description	N,N-dimethylglycine is an N-methylglycine that is glycine carrying two N-methyl substituents. It has a role as a human metabolite, a Daphnia magna metabolite and a mouse metabolite. It is a N-methyl-amino acid and a member of N-methylglycines. It is a tautomer of a N,N-dimethylglycine zwitterion. N,N-Dimethylglycine is a metabolite found in or produced by Escherichia coli . N,N-dimethylglycine is a natural product found in Paris fargesii, Homo sapiens, and other organisms with data available. N,N-dimethylglycine is a natural product found in Paris fargesii, Homo sapiens, and other organisms with data available. See also: N,N-Dimethylglycine hydrochloride ... View More ...

Computed Properties

Molecular Weight:	103.12 g/mol
XLogP3:	-2.9
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	2
Exact Mass:	103.063328530 g/mol
Monoisotopic Mass:	103.063328530 g/mol
Topological Polar Surface Area:	40.5 Å²
Heavy Atom Count:	7
Formal Charge:	0
Complexity:	70.1
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Glycine

Dichloroacetic acid

Valeric acid

Acrylic acid

Alanine

Propionic Acid

Butyric Acid

Isovaleric acid

Chloroacetic acid

Betaine

Sarcosine

Pivalic acid

Trichloroacetic Acid

3-Mercaptopropionic acid

Bromoacetic acid

hazard signal	Warning
hazard classes and categories	Acute Tox. 4 (100%)
precautionary statement codes	P264, P270, P301+P317, P330, and P501
hazard statements	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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Certificate of Analysis

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CAS #

*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

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About this item

IUPAC name	2-(dimethylamino)acetic acid
canonical smiles	CN(C)CC(=O)O
inchi	InChI=1S/C4H9NO2/c1-5(2)3-4(6)7/h3H2,1-2H3,(H,6,7)
inchi key	FFDGPVCHZBVARC-UHFFFAOYSA-N
molecular formula	C4H9NO2
synonyms	N,N-dimethylglycine 1118-68-9 dimethylglycine 2-(dimethylamino)acetic acid (Dimethylamino)acetic acid
Compound Description	N,N-dimethylglycine is an N-methylglycine that is glycine carrying two N-methyl substituents. It has a role as a human metabolite, a Daphnia magna metabolite and a mouse metabolite. It is a N-methyl-amino acid and a member of N-methylglycines. It is a tautomer of a N,N-dimethylglycine zwitterion. N,N-Dimethylglycine is a metabolite found in or produced by Escherichia coli . N,N-dimethylglycine is a natural product found in Paris fargesii, Homo sapiens, and other organisms with data available. N,N-dimethylglycine is a natural product found in Paris fargesii, Homo sapiens, and other organisms with data available. See also: N,N-Dimethylglycine hydrochloride ... View More ...

Computed Properties

Molecular Weight:	103.12 g/mol
XLogP3:	-2.9
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	2
Exact Mass:	103.063328530 g/mol
Monoisotopic Mass:	103.063328530 g/mol
Topological Polar Surface Area:	40.5 Å²
Heavy Atom Count:	7
Formal Charge:	0
Complexity:	70.1
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Glycine

Dichloroacetic acid

Valeric acid

Acrylic acid

Alanine

Propionic Acid

Butyric Acid

Isovaleric acid

Chloroacetic acid

Betaine

Sarcosine

Pivalic acid

Trichloroacetic Acid

3-Mercaptopropionic acid

Bromoacetic acid

hazard signal	Warning
hazard classes and categories	Acute Tox. 4 (100%)
precautionary statement codes	P264, P270, P301+P317, P330, and P501
hazard statements	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

Product No: AW1261

N,N-Dimethylglycine, >98.0%(T)

Product No: AW1261

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

Require a Sample Certificate of Analysis (COA) ?

Reviews

Product No: AW1261

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?