Propanoic acid, 2,3-dichloro-, methyl ester

HCID 95429
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Basic information

CAS
3674-09-7
Standard SMILES
COC(=O)C(Cl)CCl
InChIKey
OFHMODDLBXETIK-UHFFFAOYSA-N
Molecular formula
C4H6Cl2O2
Average molar mass
156.99 g/mol
Monoisotopic mass
155.97448479

Names & identifiers

Preferred name
Propanoic acid, 2,3-dichloro-, methyl ester
IUPAC
methyl 2,3-dichloropropanoate
English name
Methyl 2,3-dichloropropionate
Molecular formula
C4H6Cl2O2
Molecular weight
157

Names & synonyms

Methyl 2,3-dichloropropionate3674-09-7Propanoic acid, 2,3-dichloro-, methyl esterDTXSID00884004NSC 9373EINECS 222-940-2NSC 673822,3-Dichloropropionic acid, methyl esterAI3-11130RefChem:176326DTXCID401023479222-940-2
Show more names
2,3-dichloropropionateMETHYL-A,B-DICHLOROPROPIONATEMethyl2,3-Dichloropropionate>Methyl 2,3-dichloropropionate,98%METHYL ALPHA,BETA-DICHLOROPROPIONATE2,3-dichloro-propanoicacimethylester2,3-Dichloropropionic Acid Methyl Este2,3-DICHLOROPROPIONIC ACID METHYL ESTER
OFHMODDLBXETIK-UHFFFAOYSA-NMethyl 2,3-dichloropropanoateC4H6Cl2O2Methyl-2,3-dichloropropionateMFCD00000944Propionic acid, 2,3-dichloro-, methyl esterMethyl .alpha.,.beta.-dichloropropionatePropanoic acid,3-dichloro-, methyl ester

Database identifiers

CAS
3674-09-7
PubChem CID
95429
DTXSID
DTXSID00884004
EC Number
222-940-2
Nikkaji
J62.968E

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
8

Physicochemical properties

Boiling point
52 · 52-55 °C/2 mmHg (lit.)
Density
1.325 g/mL · 1.325 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.453(lit.)
Flash point
145 °F · 145 °F
storage temp.
30 °C · Store below +30°C.
solubility
Soluble in ether, acetone, ethanol.

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H301 (43.8%): Toxic if swallowed [Danger Acute toxicity, oral]

P203, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 16 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 2 items

Status: Active Update: 19-06-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/24508

Propanoic acid, 2,3-dichloro-, methyl ester: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesAcute Tox. 3 (43.8%)

Safety data

wgk
3
tsca
TSCA listed
ridadr
1993
hs_code
29159000
risk_code
36/37/38-10
Signal word
Danger

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationPropanoic acid, 2,3-dichloro-, methyl ester: INACTIVE

Applications

UsesMethyl 2,3-dichloropropionate can be used to produce 2-chloro-acrylic acid methyl ester at Heating. It is used as pharmaceutical intermediate.

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

Related reactions

1 records
New reaction record

Compound notes

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