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Details

Stereochemistry RACEMIC
Molecular Formula C8H16OS
Molecular Weight 160.277
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-METHYL-4-PROPYL-1,3-OXATHIANE, TRANS-

SMILES

CCC[C@@H]1CCO[C@@H](C)S1

InChI

InChIKey=GKGOLPMYJJXRGD-HTQZYQBOSA-N
InChI=1S/C8H16OS/c1-3-4-8-5-6-9-7(2)10-8/h7-8H,3-6H2,1-2H3/t7-,8-/m1/s1

HIDE SMILES / InChI

Molecular Formula C8H16OS
Molecular Weight 160.277
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:56:44 GMT 2023
Edited
by admin
on Fri Dec 15 17:56:44 GMT 2023
Record UNII
5AFX6I408R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-METHYL-4-PROPYL-1,3-OXATHIANE, TRANS-
Systematic Name English
(E)-GALBANUM OXATHIANE
Common Name English
(±)-TRANS-2-METHYL-4-PROPYL-1,3-OXATHIANE
Systematic Name English
1,3-OXATHIANE, 2-METHYL-4-PROPYL-, (2R,4R)-REL-
Common Name English
TRANS-2-METHYL-4-PROPYL-1,3-OXATHIANE, (±)-
Systematic Name English
1,3-OXATHIANE, 2-METHYL-4-PROPYL-, TRANS-
Systematic Name English
2-METHYL-4-PROPYL-TRANS-1,3-OXATHIANE
Systematic Name English
FEMA NO. 3578, TRANS-
Code English
Code System Code Type Description
FDA UNII
5AFX6I408R
Created by admin on Fri Dec 15 17:56:44 GMT 2023 , Edited by admin on Fri Dec 15 17:56:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID5051496
Created by admin on Fri Dec 15 17:56:44 GMT 2023 , Edited by admin on Fri Dec 15 17:56:44 GMT 2023
PRIMARY
PUBCHEM
6931726
Created by admin on Fri Dec 15 17:56:44 GMT 2023 , Edited by admin on Fri Dec 15 17:56:44 GMT 2023
PRIMARY
ECHA (EC/EINECS)
261-700-1
Created by admin on Fri Dec 15 17:56:44 GMT 2023 , Edited by admin on Fri Dec 15 17:56:44 GMT 2023
PRIMARY
CAS
59324-17-3
Created by admin on Fri Dec 15 17:56:44 GMT 2023 , Edited by admin on Fri Dec 15 17:56:44 GMT 2023
PRIMARY