HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

1,3-Dioxolane, 2-(2-(butylthio)-1-methylethyl)-2-methyl-

HCID 59228
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
102145-07-3
Standard SMILES
CCCCSCC(C)C1(C)OCCO1
InChIKey
AWYZLLHTKSDDLF-UHFFFAOYSA-N
Molecular formula
C11H22O2S
Average molar mass
218.36 g/mol
Monoisotopic mass
218.13405111

Names & identifiers

Preferred name
1,3-Dioxolane, 2-(2-(butylthio)-1-methylethyl)-2-methyl-
IUPAC
2-(1-butylsulfanylpropan-2-yl)-2-methyl-1,3-dioxolane

Names & synonyms

102145-07-3BRN 54951282-Methyl-2-(1-methyl-2-butylthioethyl)-1,3-dioxolane2-(2-(Butylthio)-1-methylethyl)-2-methyl-1,3-dioxolane1,3-DIOXOLANE, 2-(2-(BUTYLTHIO)-1-METHYLETHYL)-2-METHYL-1,3-Dioxolane, 2-[2-(butylthio)-1-methylethyl]-2-methyl-RefChem:2189192-(1-(Butylthio)propan-2-yl)-2-methyl-1,3-dioxolane2-[1-(butylsulfanyl)propan-2-yl]-2-methyl-1,3-dioxolaneDTXSID40907165

Database identifiers

CAS
102145-07-3
PubChem CID
59228
DTXSID
DTXSID40907165

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
43.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
14
Formal charge
0
Complexity
155

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes