Methyl 2-chloro-3-hydroxypropionate - CAS 98070-39-4

Catalog:	BB042109
Product Name:	Methyl 2-chloro-3-hydroxypropionate
CAS:	98070-39-4
Synonyms:	methyl 2-chloro-3-hydroxypropanoate

Technical Data

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Computed Properties

IUPAC Name:	methyl 2-chloro-3-hydroxypropanoate
Description:	Methyl 2-chloro-3-hydroxypropionate (CAS# 98070-39-4) is a useful research chemical compound.
Molecular Weight:	138.55
Molecular Formula:	C4H7ClO3
Canonical SMILES:	COC(=O)C(CO)Cl
InChI:	InChI=1S/C4H7ClO3/c1-8-4(7)3(5)2-6/h3,6H,2H2,1H3
InChI Key:	IPNQALYYANAHGS-UHFFFAOYSA-N
Boiling Point:	105-109 °C / 20 mmHg
Density:	1.319 g/cm³
MDL:	MFCD00159573
LogP:	-0.24090

Publication Number	Title	Priority Date
US-2013090442-A1	Synthesis of hyperbranched polyacrylates by emulsion polymerizsation of inimers	20111005
US-9777082-B2	Synthesis of hyperbranched polyacrylates by emulsion polymerizsation of inimers	20111005
CA-2665607-A1	Synthesis of inimers and hyperbranched polymers	20061004
CA-2665607-C	Synthesis of inimers and hyperbranched polymers	20061004
CN-101553571-A	Synthesis of inimers and hyperbranched polymers	20061004

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	83.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	138.0083718
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	138.0083718
Rotatable Bond Count:	3
Topological Polar Surface Area:	46.5 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1