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2,4-Difluorophenyl chloroformate

HCID 18972753
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
400900-00-7
Standard SMILES
O=C(Cl)Oc1ccc(F)cc1F
InChIKey
FNNSHABLLQXXID-UHFFFAOYSA-N
Molecular formula
C7H3ClF2O2
Average molar mass
192.55 g/mol
Monoisotopic mass
191.9789634

Names & identifiers

Preferred name
2,4-Difluorophenyl chloroformate
IUPAC
(2,4-difluorophenyl) carbonochloridate
English name
2,4-Difluorophenyl Chloroformate
Molecular formula
C7H3ClF2O2
Molecular weight
192.55

Names & synonyms

2,4-difluorophenyl chloroformate400900-00-7RefChem:443584843-102-82,4-difluorophenyl carbonochloridateMFCD24141121(2,4-difluorophenyl) carbonochloridate2,4-difluorophenylchloroformateSCHEMBL2830676AC6073AKOS020226185CS-12715
Show more names
2,4-Dichlorophenyl chloroformate
SY173125Carbonochloridic acid, 2,4-difluorophenyl esterEN300-199635F831882

Database identifiers

CAS
400900-00-7
PubChem CID
18972753
EC Number
843-102-8

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
177

Physicochemical properties

Boiling point
184.9 · 184.9±30.0 °C(Predicted)
Density
1.477 · 1.477±0.06 g/cm3(Predicted)
Symbol(GHS)
5 · GHS05,GHS06
Signal word
Danger
Hazard statements
300 · H300+H310+H330-H314-H290
Precautionary statements
501 · P501-P260-P270-P262-P234-P271-P264-P280-P284-P390-P361+P364-P303+P361+P353-P301+P330+P331-P301+P310+P330-P304+P340+P310-P305+P351+P338+P310-P403+P233-P406-P405

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Danger

H227 (100%): Combustible liquid [Warning Flammable liquids]

P210, P260, P261, P262, P264, P270, P271, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P361+P364, P363, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 4 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS05,GHS06
Hazard statements
H300+H310+H330-H314-H290
Precautionary statements
P501-P260-P270-P262-P234-P271-P264-P280-P284-P390-P361+P364-P303+P361+P353-P301+P330+P331-P301+P310+P330-P304+P340+P310-P305+P351+P338+P310-P403+P233-P406-P405

Chemistry & industry

Suppliers11 total

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
韶远科技(上海)有限公司4000665055 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
砌块化学科技(上海)有限公司021-20432219 13918097649 · [email protected]
河南阿尔法化工有限公司0371-55051623 18137891487 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
河南伊诺凯新材料有限公司15565215982 15565215982 · [email protected]
郑州艾克姆化工有限公司13303867194 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
吉林中科研伸科技有限公司043180534350 19917294565 · [email protected]

Related reactions

1 records
New reaction record
HRID 1143615 reaction equation
HRID 1143615As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

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