Cas no 67421-85-6 (6-Methyl-4,5-dithia-1-heptene)
6-Methyl-4,5-dithia-1-heptene structure
Product Name:6-Methyl-4,5-dithia-1-heptene
CAS No:67421-85-6
MF:C6H12S2
MW:148.289479255676
CID:4724125
Update Time:2023-08-16
6-Methyl-4,5-dithia-1-heptene Chemical and Physical Properties
Names and Identifiers
-
- 6-methyl-4,5-dithia-1-heptene
- allyl-isopropyl-disulfane
- 1-Allyl-2-isopropyldisulfane
- 6-methyl-4,5-dithia heptene
- BQMYJJMTHCLMRB-UHFFFAOYSA-N
- 2-(prop-2-enyldisulfanyl)propane
- Disulfide, 1-methylethyl 2-propenyl
- Disulfide, 1-methylethyl 2-propen-1-yl
- 6-Methyl-4,5-dithia-1-heptene
-
- Inchi： 1S/C6H12S2/c1-4-5-7-8-6(2)3/h4,6H,1,5H2,2-3H3
- InChI Key： BQMYJJMTHCLMRB-UHFFFAOYSA-N
- SMILES： S(C(C)C)SCC=C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 59.5
- Topological Polar Surface Area: 50.6
6-Methyl-4,5-dithia-1-heptene Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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