CAS 5616-32-0 | 2-(Methylamino);acetonitrile | CAS Number 5616-32-0

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5616-32-0 | 2-(Methylamino);acetonitrile

CAS No: 5616-32-0 Catalog No: AG003S3D MDL No:MFCD00058964

Product Description

Catalog Number:

AG003S3D

Chemical Name:

2-(Methylamino);acetonitrile

CAS Number:

5616-32-0

Molecular Formula:

C3H6N2

Molecular Weight:

70.0931

MDL Number:

MFCD00058964

IUPAC Name:

2-(methylamino)acetonitrile

InChI:

InChI=1S/C3H6N2/c1-5-3-2-4/h5H,3H2,1H3

InChI Key:

PVVRRUUMHFWFQV-UHFFFAOYSA-N

SMILES:

CNCC#N

EC Number:

227-037-7

NSC Number:

99320

Properties

Complexity:

49.2

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

70.053g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

70.095g/mol

Monoisotopic Mass:

70.053g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

35.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.4

Literature

Title	Journal
Analysis of kanamycin A in human plasma and in oral dosage form by derivatization with 1-naphthyl isothiocyanate and high-performance liquid chromatography.	Journal of separation science 20060301
Trace analysis of tobramycin in human plasma by derivatization and high-performance liquid chromatography with ultraviolet detection.	Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20021125