HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol)

HCID 83116
NotesReactions
Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
13078-45-0
Standard SMILES
OC(CCl)COCCOCC(O)CCl
InChIKey
MEBAOCKWPXDTDB-UHFFFAOYSA-N
Molecular formula
C8H16Cl2O4
Average molar mass
247.11 g/mol
Monoisotopic mass
246.0425644

Overview

See other relationships...

Names & identifiers

Preferred name
1,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol)
IUPAC
1-chloro-3-[2-(3-chloro-2-hydroxypropoxy)ethoxy]propan-2-ol
English name
1,1'-(ethylenedioxy)bis(3-chloropropan-2-ol)
Molecular formula
C8H16Cl2O4
Molecular weight
247.12

Names & synonyms

13078-45-01,1'-(Ethylenedioxy)bis(3-chloropropan-2-ol)1-chloro-3-[2-(3-chloro-2-hydroxypropoxy)ethoxy]propan-2-olEINECS 235-980-0BRN 24313621,1'-[ethane-1,2-diylbis(oxy)]bis(3-chloropropan-2-ol)1,1'-(Ethylenedioxy)bis(3-chloro-2-propanol)1,1/'-(Ethylenedioxy)bis(3-chloropropan-2-ol)2-Propanol, 1,1'-(ethylenedioxy)bis(3-chloro-U 27,421SCHEMBL7535158DTXSID20926899
Show more names
U-274211,10-Dichloro-4,7-dioxadecane-2,9-diol1,1'-(Ethylenebisoxy)bis(3-chloro-2-propanol)2-Propanol, 1,1'-[1,2-ethanediylbis(oxy)]bis[3-chloro-
MEBAOCKWPXDTDB-UHFFFAOYSA-NNS0005158937569-89-4

Database identifiers

CAS
13078-45-0
PubChem CID
83116

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
58.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
14
Formal charge
0
Complexity
112

Physicochemical properties

EWG's Food Scores
1 · 1

Chemistry & industry

Suppliers1 total

DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
DTXSID
DTXSID20926899
EC Number
235-980-0
Nikkaji
J25.809A