AG003BLA

28286-88-6 | 2-(2,6-Dimethyl-4H-pyran-4-ylidene)malononitrile

AG003BLA

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CAS Number	28286-88-6
Catalog Number	AG003BLA(AGN-PC-0JLMLI)
Chemical Name	2-(2,6-Dimethyl-4H-pyran-4-ylidene)malononitrile
IUPAC Name	2-(2,6-dimethylpyran-4-ylidene)propanedinitrile
InChI	InChI=1S/C10H8N2O/c1-7-3-9(4-8(2)13-7)10(5-11)6-12/h3-4H,1-2H3
InChI Key	XYBUCJYJVULPHW-UHFFFAOYSA-N
MDL Number	MFCD00181519
Molecular Formula	C10H8N2O
Molecular Weight	172.1833
SMILES	N#C/C(C#N)=C1C=C(C)OC(C)=C1
Synonyms	28286-88-6, (2,6-Dimethyl-4H-pyran-4-ylidene)malononitrile, 2-(2,6-DIMETHYL-4H-PYRAN-4-YLIDENE)MALONONITRILE, Propanedinitrile, (2,6-dimethyl-4H-pyran-4-ylidene)-, 2-(2,6-dimethylpyran-4-ylidene)propanedinitrile, 4-(Dicyanomethylene)-2,6-dimethyl-4H-pyran, 4-(dicyanomethylene)-2,6-dimethyl-4H-pyrane, Propanedinitrile, 2-(2,6-dimethyl-4H-pyran-4-ylidene)-, 4-dicyanomethylene-2,6-dimethyl-4H-pyran, 2-(2,6-Dimethyl-4H-pyran-4-ylidene)propanedinitrile, AC1L3PQK, AC1Q4QCE, ACMC-1CK2M, SCHEMBL1097940, Jsp005435, DTXSID2067373, CTK3J0860, XYBUCJYJVULPHW-UHFFFAOYSA-N, ZINC391459, KS-000012CX, ANW-26362, MFCD00181519, STK506912, AKOS002337172, AC-6678, AN-9782, CD-1065, FCH1114736, MCULE-1130906660, RTR-012507, TRA-0193051, AJ-21087, AK122495, ZB012022, TR-012507, A5383, D2791, FT-0687260, ST50983887, 2,6-Dimethyl-4-(dicyanomethylene)-4H-pyran, VU0612266-1, (2,6-dimethyl-4H-pyran-4-ylidene)malononitril, (2,6-Dimethyl-4H-pyran-4-ylidene)propanedinitril, 286D886, (2,6-dimethyl-4H-pyran-4-ylidene)propanedinitrile, 2-(2,6-dimethyl-4H-pyran-4-ylidene) malononitrile, 2-(2,6-Dimethyl-4H -pyran-4-ylidene) malononitrile, I14-17172, (2,6-dimethylpyran-4-ylidene)methane-1,1-dicarbonitrile, F3358-0430, 2-(2-tert-butyl-6-methyl-4H-pyran-4-ylidene)malononitrile, KST-1A3506, C10-H8-N2-O, AR-1A1997, CID119915, 2-(2-tert-Butyl-6-methyl-pyran-4-ylidene)-malononitrile, 2917-56-8,

Complexity	382
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.064g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	172.187g/mol
Monoisotopic Mass	172.064g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	56.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H301+H311+H331-H315-H319
Precuationary statements	P261-P264-P270-P271-P280-P301+P310+P330-P302+P352+P312+P361+P364-P304+P340+P311-P305+P351+P338+P337+P313-P403+P233-P405-P501
Siginal words

Certificate of Analysis

Lot Number