2-Phenoxyethyl Chloroformate - CAS 34743-87-8

Catalog:	BB022271
Product Name:	2-Phenoxyethyl Chloroformate
CAS:	34743-87-8
Synonyms:	carbonochloridic acid 2-phenoxyethyl ester; 2-phenoxyethyl carbonochloridate

Technical Data

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Computed Properties

IUPAC Name:	2-phenoxyethyl carbonochloridate
Description:	2-Phenoxyethyl Chloroformate (CAS# 34743-87-8) is a useful research chemical.
Molecular Weight:	200.62
Molecular Formula:	C9H9ClO3
Canonical SMILES:	C1=CC=C(C=C1)OCCOC(=O)Cl
InChI:	InChI=1S/C9H9ClO3/c10-9(11)13-7-6-12-8-4-2-1-3-5-8/h1-5H,6-7H2
InChI Key:	GQGPDDREGSRIRX-UHFFFAOYSA-N
Boiling Point:	282.5 °C at 760 mmHg
Density:	1.243 g/cm³
Appearance:	Low melting solid
LogP:	2.44080

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Complexity:	155
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	200.0240218
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	200.0240218
Rotatable Bond Count:	5
Topological Polar Surface Area:	35.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8