1-Chloro-4-(2-chloroethoxy)benzene

HCID 83034CAS 13001-28-0
Substructure searchFind similar structures

Basic information

Standard SMILES
ClCCOc1ccc(Cl)cc1
InChIKey
DFJCCNZMGVNBKQ-UHFFFAOYSA-N
Molecular formula
C8H8Cl2O
Average molar mass
191.05 g/mol
Monoisotopic mass
189.9952203

Names & identifiers

Preferred name
1-Chloro-4-(2-chloroethoxy)benzene
IUPAC
1-chloro-4-(2-chloroethoxy)benzene
English name
1-Chloro-4-(2-chloroethoxy)benzene
Molecular formula
C8H8Cl2O
Molecular weight
191.05

Names & synonyms

1-Chloro-4-(2-chloroethoxy)benzeneBenzene, 1-chloro-4-(2-chloroethoxy)-2-chloroethyl 4-chlorophenyl etherF6MPD4B6F94-(2-Chloroethoxy)chlorobenzeneDTXSID4074487Phenol, 4-chloro-O-[2-chloroethyl]-Phenol, 4-chloro-O-(2-chloroethyl)-RefChem:197017DTXCID7033945DFJCCNZMGVNBKQ-UHFFFAOYSA-N13001-28-0
Show more names
4-(2-Chloroethoxy)-Chloro-Benzene1-Chloro-4-(chloroethoxy)-benzene
2-(4-CHLOROPHENOXY)ETHYL CHLORIDEMFCD032653712-(4-Chlorophenoxy)ethylchlorideEINECS 235-833-01-Chloro-2-(4-chlorophenoxy)ethaneUNII-F6MPD4B6F9SCHEMBL58244964-(2-chloroethoxy)-chlorobenzene

Database identifiers

CAS
13001-28-0
PubChem CID
83034
DTXSID
DTXSID4074487
UNII
F6MPD4B6F9
EC Number
235-833-0
Nikkaji
J317.758K

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
11

Physicochemical properties

Melting point
39 °C · 39 °C
Boiling point
184 · 184-186 °C(Press: 92 Torr)
Density
1.246 · 1.246±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
CAS DataBase Reference
13001 · 13001-28-0(CAS DataBase Reference)
FDA UNII
6 MPD4B6F9 · F6MPD4B6F9

Safety & regulation

Safety data

Signal word
Danger
Symbol(GHS)
GHS05,GHS07,GHS09
Hazard statements
H302+H312-H315-H318-H411
Precautionary statements
P264-P270-P273-P280-P301+P312+P330-P302+P352+P312-P305+P351+P338+P310-P332+P313-P391-P501

Chemistry & industry

Upstream & downstream products

Suppliers33 total

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海硅兰医药科技有限公司17301772648; 17301772648 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]

Related reactions

3 records
New reaction record

Linked notes

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