Methyl 2-methylbenzoate - CAS 89-71-4

Catalog:	BB039578
Product Name:	Methyl 2-methylbenzoate
CAS:	89-71-4
Synonyms:	methyl 2-methylbenzoate

Technical Data

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Computed Properties

IUPAC Name:	methyl 2-methylbenzoate
Description:	Methyl 2-methylbenzoate (CAS# 89-71-4) is a useful research chemical.
Molecular Weight:	150.17
Molecular Formula:	C9H10O2
Canonical SMILES:	CC1=CC=CC=C1C(=O)OC
InChI:	InChI=1S/C9H10O2/c1-7-5-3-4-6-8(7)9(10)11-2/h3-6H,1-2H3
InChI Key:	WVWZECQNFWFVFW-UHFFFAOYSA-N
Boiling Point:	207-208 °C
Density:	1.073 g/cm³
Appearance:	Colorless liquid
MDL:	MFCD00008428
LogP:	1.78160
Vapor Pressure:	0.16 [mmHg]

Publication Number	Title	Priority Date
CN-113244942-A	Non-metal nitrogen-doped porous carbon catalyst and method for preparing methyl carboxylate compound	20210427
CN-112542912-A	Motor end cover and preparation process thereof	20201222
CN-112542912-B	Motor end cover and preparation process thereof	20201222
CN-111606829-A	Production method of o-methyl formate benzyl sulfonamide	20200707
CN-111807997-A	Synthesis method of N- (4-methoxycarbonyl-3-aminosulfonylbenzyl) methanesulfonamide	20200627

PMID	Publication Date	Title	Journal
21938612	20110901	Kinetic fragility of binary and ternary glass forming liquid mixtures	The European physical journal. E, Soft matter
21384814	20110401	Protecting group free synthesis of 6-substituted naphthols and binols	The Journal of organic chemistry
20731399	20100923	Glass transition in binary eutectic systems: best glass-forming composition	The journal of physical chemistry. B
20178328	20100318	Structural relaxation dynamics in binary glass-forming molecular liquids with ideal and complex mixing behavior	The journal of physical chemistry. B
19288479	20090101	Identification of a highly efficient alkylated pincer thioimido-palladium(II) complex as the active catalyst in Negishi coupling	Chemistry (Weinheim an der Bergstrasse, Germany)

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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:	143
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	150.068079557
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	150.068079557
Rotatable Bond Count:	2
Topological Polar Surface Area:	26.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8