AG00EAFO

59937-28-9 | 1,3-bis(propan-2-yl) 2-(2H-1,3-dithiol-2-ylidene)propanedioate

AG00EAFO

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	59937-28-9
Catalog Number	AG00EAFO(AGN-PC-0JK6QD)
Chemical Name	1,3-bis(propan-2-yl) 2-(2H-1,3-dithiol-2-ylidene)propanedioate
EC Number	261-987-3
IUPAC Name	dipropan-2-yl 2-(1,3-dithiol-2-ylidene)propanedioate
InChI	InChI=1S/C12H16O4S2/c1-7(2)15-10(13)9(11(14)16-8(3)4)12-17-5-6-18-12/h5-8H,1-4H3
InChI Key	YPIQVCUJEKAZCP-UHFFFAOYSA-N
MDL Number	MFCD00867646
Molecular Formula	C12H16O4S2
Molecular Weight	288.3830
SMILES	CC(C)OC(/C(C(OC(C)C)=O)=C1SC=CS1)=O
UNII	RV59PND975
Synonyms	diisopropyl 1,3-dithiol-2-ylidenemalonate, malotilate, NKK 105, NKK-105, malotilate, 59937-28-9, Kantec, Malotilatum, NKK 105, NKK-105, Diisopropyl 1,3-dithiol-2-ylidenemalonate, Malotilatum [INN-Latin], Malotilato [INN-Spanish], dipropan-2-yl 2-(1,3-dithiol-2-ylidene)propanedioate, UNII-RV59PND975, Malotilate [USAN:INN:JAN], EINECS 261-987-3, CL-1500, Diisopropyl-1,3-dithiol-2-ylidenemalonate, RV59PND975, Diisopropyl 2-(1,3-dithiol-2-ylidene)malonate, YPIQVCUJEKAZCP-UHFFFAOYSA-N, Diisopropyl 1,3-dithiole-delta(sup 2,alpha)-malonate, NCGC00164588-01, 1,3-Dithiol-2-ylidenepropanedioic acid, bis(1-methylethyl) ester, Propanedioic acid, 1,3-dithiol-2-ylidene-, bis(1-methylethyl) ester, DSSTox_CID_26463, DSSTox_RID_81637, DSSTox_GSID_46463, Malotilato, MALONIC ACID, (1,3-DITHIOL-2-YLIDENE)-, DIISOPROPYL ESTER, CAS-59937-28-9, Tractal, Malotilate/, C12H16O4S2, Kantec (TN), AC1Q5XTO, MLS006010037, Malotilate (JAN/USAN/INN), SCHEMBL635496, AC1L1H78, NKK105, CHEMBL1697754, DTXSID7046463, CHEBI:31798, CTK8E7254, KS-00000XLR, HMS3654I08, BCP01805, HY-A0060, ZINC1542902, Tox21 112214, Tox21_112214, ABP000477, KM0356, MFCD00867646, s1137, AKOS025119303, Tox21_112214_1, BCP9000892, CS-1594, DA-3857, VA11228, NCGC00164588-02, NCGC00164588-03, AK327287, AN-39548, AS-11770, CC-30142, CJ-24326, LS-88812, SC-13551, SMR002530051, AB0007968, TC-030563, Diisopropyl (1,3-Dithiol-2-ylidene)malonate, FT-0082404, FT-0601567, M2674, SW219173-1, D01770, AB01566806_01, 937M289, C-18144, diisopropyl 2-(1,3-dithiol-2-ylidene)propanedioate, Bis(1-methylethyl) 1,3-dithiol-2-ylidenepropanedioate, BRD-K97884852-001-02-1, (1,3-Dithiol-2-ylidene)malonic Acid Diisopropyl Ester, 1,3-Dithiol-2-ylidenepropanedioic acid bis(1-methylethyl) ester, CID4006, AR-1J2870, C12-H16-O4-S2, A2486, A10552, C024808, 2-(1,3-Dithiol-2-ylidene)propanedioic acid 1,3-bis(1-methylethyl) ester, 6164-81-4,

Complexity	363
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	288.049g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	288.376g/mol
Monoisotopic Mass	288.049g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	103A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number