AG003S3D

5616-32-0 | Methylaminoacetonitrile

AG003S3D

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CAS Number	5616-32-0
Catalog Number	AG003S3D(AGN-PC-0JKP6Y)
Chemical Name	Methylaminoacetonitrile
EC Number	227-037-7
IUPAC Name	2-(methylamino)acetonitrile
InChI	InChI=1S/C3H6N2/c1-5-3-2-4/h5H,3H2,1H3
InChI Key	PVVRRUUMHFWFQV-UHFFFAOYSA-N
MDL Number	MFCD00058964
Molecular Formula	C3H6N2
Molecular Weight	70.0931
NSC Number	99320
SMILES	N#CCNC
Synonyms	Methylaminoacetonitrile, 5616-32-0, 2-(methylamino)acetonitrile, (Methylamino)acetonitrile, Acetonitrile, (methylamino)-, Sarcosinonitrile, N-Methylaminoacetonitrile, Glycinonitrile, N-methyl-, Acetonitrile, 2-(methylamino)-, CH3NHCH2CN, 2-(methylamino)ethanenitrile, PVVRRUUMHFWFQV-UHFFFAOYSA-N, C3H6N2, NSC99320, EINECS 227-037-7, NSC 99320, 2-methylaminoacetonitrile, ACMC-209lr0, N-cyanomethyl-N-methylamine, 2-(Methylamino);acetonitrile, Acetonitrile,2-(methylamino)-, AC1L1W66, AC1Q411J, AC1Q411K, DTXSID3063962, CTK3J2418, KS-000016AI, (Methylamino)acetonitrile AldrichCPR, 8210AB, ANW-32458, BBL104222, MFCD00058964, NSC-99320, SBB071612, STL558209, ZINC19264728, (Methylamino)acetonitrile, AldrichCPR, AKOS000148535, MCULE-4334159739, VZ32752, AJ-72733, CJ-16064, SC-13788, RT-000617, FT-0635783, M0140, ST45026641, Y-8674, A830939, S14-0816, 2-(Methylamino)-acetonitrile, C3-H6-N2, CID36652, N-METHYLGLYCINONITRILE SULFATE, 2-(methylamino)acetonitrile hydrochloride,

Complexity	49.2
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	70.053g/mol
Formal Charge	0
Heavy Atom Count	5
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	70.095g/mol
Monoisotopic Mass	70.053g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	35.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P210-P280-P301+P330+P331-P302+P352-P304+P312-P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

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