AG0035OJ

3333-52-6 | 2,2,3,3-Tetramethylbutanedinitrile

AG0035OJ

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CAS Number	3333-52-6
Catalog Number	AG0035OJ(AGN-PC-0JKE9V)
Chemical Name	2,2,3,3-Tetramethylbutanedinitrile
IUPAC Name	2,2,3,3-tetramethylbutanedinitrile
InChI	InChI=1S/C8H12N2/c1-7(2,5-9)8(3,4)6-10/h1-4H3
InChI Key	ZVQXQPNJHRNGID-UHFFFAOYSA-N
MDL Number	MFCD00040683
Molecular Formula	C8H12N2
Molecular Weight	136.1943
NSC Number	39746
RTECS Number	WN4025000
SMILES	CC(C#N)(C(C#N)(C)C)C
UNII	116XMU2GHK
Synonyms	tetramethylsuccinonitrile, TMSN, Tetramethylsuccinonitrile, 3333-52-6, 2,2,3,3-Tetramethylsuccinonitrile, Butanedinitrile, tetramethyl-, 2,2,3,3-Tetramethylbutanedinitrile, Tetramethylsuccinodinitrile, Tetramethylsuccinotrile, Tetramethyl succinonitrile, TETRAMETHYLBUTANEDINITRILE, TMSN, Succinonitrile, tetramethyl-, Tetramethylsuccinic acid dinitrile, Tetramethylsukcinonitril, 2,3-Dicyano-2,3-dimethylbutane, UNII-116XMU2GHK, NSC 39746, CCRIS 1551, Tetramethylsukcinonitril [Czech], HSDB 7193, BRN 1752813, 116XMU2GHK, CP 75475, AI3-23333, AC1L2CPI, AC1Q1LHL, AC1Q4QKX, Tetramethyl butanedinitrile, ACMC-1CQ6W, DSSTox_CID_6125, DSSTox_RID_78028, DSSTox_GSID_26125, 4-02-00-02054 (Beilstein Handbook Reference), SCHEMBL576290, CHEMBL3182970, DTXSID0026125, CTK4H0404, ZVQXQPNJHRNGID-UHFFFAOYSA-, ZVQXQPNJHRNGID-UHFFFAOYSA-N, ZINC388905, NSC39746, WLN: NCX1&1&X1&1&CN, Tox21_200573, 2,2,3,3-Tetramethyl-succinonitrile, ANW-27615, BBL104218, Butanedinitrile, tetramethyl- (9CI), MFCD00040683, NSC-39746, STL558082, 2,2,3,3-tetramethyl-butanedinitrile, 2,2,3,3-Tetramethylsuccinonitrile #, AKOS003333998, Butanedinitrile,2,2,3,3-tetramethyl-, FCH1116218, LS-1210, MCULE-8159947270, KS-0000168T, NCGC00248713-01, NCGC00258127-01, AJ-20777, AK-80282, AN-18969, ST013917, ZB011704, CAS-3333-52-6, 2,2,3,3-Tetramethylbutanedinitrile, 97%, AX8153617, TR-013966, FT-0695327, V2336, 1,1,2,2-tetramethylethane-1,2-dicarbonitrile, C-54487, InChI=1/C8H12N2/c1-7(2,5-9)8(3,4)6-10/h1-4H3, Tetramethysuccinitril, Tetrametylsuccinonitril, Tetrametilsuccinonitrilo, Tetramethyl succinodinitrile, C8H12N2, CID18745, C8-H12-N2, NA2811, UN2811, Butanodinitrilo, 2,2,3,3-tetrametil-, T0155,

Complexity	192
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	136.1g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	136.198g/mol
Monoisotopic Mass	136.1g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	47.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H300-H311+H331-H371-H373
Precuationary statements	P260-P264-P280-P301+P310-P311
Siginal words

Certificate of Analysis

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