CAS 7693-41-6 Carbonochloridic acid, 4-methoxyphenyl ester (HCID 82128)

Names & identifiers

Preferred name: Carbonochloridic acid, 4-methoxyphenyl ester
IUPAC: (4-methoxyphenyl) carbonochloridate
English name: 4-Methoxyphenyl chloroformate
Molecular formula: C8H7ClO3
Molecular weight: 186.59

Names & synonyms

7693-41-64-methoxyphenyl carbonochloridateCarbonochloridic acid, 4-methoxyphenyl esterDTXSID8064771RefChem:574537DTXCID8047929628-379-34-Methoxyphenyl chloroformateChloroformic acid 4-methoxyphenyl ester(4-methoxyphenyl) carbonochloridateMFCD00013258carbonochloridic acid 4-methoxyphenyl ester

Show more names

MURA-0074-methoxyphenylestep-Methoxyphenol chloroformatep-Methoxyphenoxycarbonyl chloride4-Methoxyphenyl chloroformate,98%4-METHOXYPHENYL CHLOROFORMATE 98%4-Methoxyphenylchloroformate 99% By Gc

4-methoxyphenylchloroformateCarbonochloridic acid,4-methoxyphenyl esterp-methoxyphenyl chloroformateSCHEMBL2190404-methoxy-phenyl chloroformate4-methoxyphenylcarbonochloridateorb31440414-(methoxy)phenyl chloroformate

Database identifiers

CAS: 7693-41-6
PubChem CID: 82128
DTXSID: DTXSID8064771
EC Number: 628-379-3
Nikkaji: J266.741J

Properties

Computed structural properties

XLogP: 2.6
Topological polar surface area: 35.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 12
Formal charge: 0
Complexity: 152

Experimental & physicochemical properties

SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy

Physicochemical properties

Boiling point: 49 °C0.27 · 49 °C0.27 mm Hg(lit.)
Density: 1.255 g/mL · 1.255 g/mL at 25 °C(lit.)
refractive index: 20 · n20/D 1.5254(lit.)
Flash point: 230 °F · >230 °F
storage temp.: 2 · 2-8°C
form: Liquid
color: Clear colorless to pale yellow
InChI: InChI=1S/C8H7ClO3/c1-11-6-2-4-7(5-3-6)12-8(9)10/h2-5H,1H3
InChIKey: CCFSGQKTSBIIHG-UHFFFAOYSA-N
SMILES: C(Cl)(OC1=CC=C(OC)C=C1)=O
EPA Substance Registry System: 4 · Carbonochloridic acid, 4-methoxyphenyl ester (7693-41-6)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 5 · GHS05,GHS06
Signal word: Danger
Hazard statements: 301 · H301+H311+H331-H314
Precautionary statements: 261 · P261-P270-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
PPE: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
Hazard Codes: T,C
Risk Statements: 23 · 23/24/25-34
Safety Statements: 26 · 26-27-36/37/39-45
RIDADR: 3277 · UN 3277 6.1/PG 2
WGK Germany: 3 · 3
TSCA: TSCA listed
HazardClass: 6.1 · 6.1(a)
PackingGroup: II
HS Code: 29159000 · 29159000
Storage Class: 6.1 A · 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
Hazard Classifications: 3 OralEye · Acute Tox. 3 OralEye Dam. 1Skin Corr. 1B
Limited Quantities: 100 ml · 100ml (liquid) or 0.5 Kg (solid)
Excepted Quantities: Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml)

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 3 (100%)

Safety data

PPE: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
wgk: 3
tsca: TSCA listed
ridadr: UN 3277 6.1/PG 2
hs_code: 29159000
risk_code: 23/24/25-34
Signal word: Danger
Symbol(GHS): GHS05,GHS06
hazard_code: T,C
safety_code: 26-27-36/37/39-45
hazard_class: 6.1(a)
Storage Class: 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
packing_group: II
Hazard statements: H301+H311+H331-H314
Limited Quantities: 100ml (liquid) or 0.5 Kg (solid)
Excepted Quantities: Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml)
Hazard Classifications: Acute Tox. 3 OralEye Dam. 1Skin Corr. 1B
Precautionary statements: P261-P270-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338