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-Propanol, 3-chloro-, phosphate (3:1)

HCID 14034
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
1067-98-7
Standard SMILES
O=P(OCCCCl)(OCCCCl)OCCCCl
InChIKey
WOURXYYHORRGQO-UHFFFAOYSA-N
Molecular formula
C9H18Cl3O4P
Average molar mass
327.6 g/mol
Monoisotopic mass
326.000829

Overview

Tri(3-chloropropyl) phosphate is a trialkyl phosphate.

Names & identifiers

Preferred name
1-Propanol, 3-chloro-, phosphate (3:1)
IUPAC
tris(3-chloropropyl) phosphate
English name
Tris(monochloropropyl) phosphate
Molecular weight
0

Names & synonyms

1067-98-73-Chloro-1-propanol phosphate (3:1)1-Propanol, 3-chloro-, phosphate (3:1)RefChem:436269Tris(3-chloropropyl) phosphateTri(chloropropyl) phosphateTRIS(3-CHLOROPROPYL)PHOSPHATETris(chloropropyl)phosphate26248-87-3Tris(monochloropropyl) phosphateTRIS(3-CHLORO-1-PROPYL)PHOSPHATEFG 8115S
Show more names
Tri(Chloropropyl) Phosphate (TCPP)Tris(monochloropropyl) phosphate, isomer mixture
FG 8115starbld00394761-Propanol, 3-chloro-,phosphate (3:1)SCHEMBL233122Tri(3-chloropropyl) phosphateorb3144591DTXSID80862522CHEBI:191169

Database identifiers

CAS
1067-98-7、26248-87-3
PubChem CID
14034
DTXSID
DTXSID80862522
ChEBI
CHEBI:191169
Nikkaji
J862A

Properties

Computed structural properties

XLogP
2
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
12
Heavy atoms
17
Formal charge
0
Complexity
185

Experimental & physicochemical properties

SpringerMaterials PropertiesViscosity

Physicochemical properties

Boiling point
178 °C · 178 °C(Press: 0.1 Torr)
storage temp.
-20 °C · Hygroscopic, -20°C Freezer, Under inert atmosphere
solubility
Chloroform (Slightly), Ethyl Acetate (Slightly)
form
Oil
color
Colourless
Stability
Hygroscopic, Moisture Sensitive
Toxicity
50 oral · LD50 oral in rat: 1500mg/kg

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Other Safety InformationPEC / SN / Other assessments - Trisphosphates: Environment

Toxicology

EPA Provisional Peer-Reviewed Toxicity Values · 3 items

Tris(3-chloro-1-propyl)phosphate

PDF Document

2011

Safety data

Toxicity
LD50 oral in rat: 1500mg/kg

Chemistry & industry

Applications

UsesTris(3-chloropropyl) Phosphate is a flame retardant.

Suppliers8 total

艾吉析科技(上海)有限公司17717235263 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
TargetMol 中国(陶术生物)400-821-0310 15002144251 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]

Additional notes

DefinitionChEBI: Tri(3-chloropropyl) phosphate is a trialkyl phosphate.

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes