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Methyl 2-hydroxy-3-methoxy-5-(2-propen-1-yl)benzoate

Methyl 2-hydroxy-3-methoxy-5-(2-propen-1-yl)benzoate structure

CAS No:
85614-43-3
Formula:
C12H14O4
Chemical Name:
Methyl 2-hydroxy-3-methoxy-5-(2-propen-1-yl)benzoate
Synonyms:
Benzoic acid,2-hydroxy-3-methoxy-5-(2-propen-1-yl)-,methyl ester;Benzoic acid,2-hydroxy-3-methoxy-5-(2-propenyl)-,methyl ester;Methyl 2-hydroxy-3-methoxy-5-(2-propen-1-yl)benzoate;Methyl 5-allyl-2-hydroxy-3-methoxybenzoate;Methyl 5-allyl-3-methoxysalicylate

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Methyl 2-hydroxy-3-methoxy-5-(2-propen-1-yl)benzoate Basic Attributes

Molecular Weight：

222.24

Exact Mass：

222.24

EC Number：

287-929-7

DSSTox ID：

DTXSID00234843

HScode：

2918990090

Characteristics

PSA：

55.76000

XLogP3：

1.91590

Appearance：

WHITE TO LIGHT YELLOW POWDER, CRYSTALS,CRYSTALLINE POWDER AND/OR CHUNKS

Density：

1.144±0.06 g/cm3

Melting Point：

55-55.5 °C

Boiling Point：

173-174 °C @ Press: 12 Torr

Flash Point：

>110ºC

Refractive Index：

1.535

PKA：

10.10±0.23

Safety Information

wgk germany：

hazard class code：

22-36/37/38

safety instructions：

26-36

Marks：

Xn,Xi

GHS Classification：

|Warning|H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:222.24
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:222.08920892
Monoisotopic Mass:222.08920892
Topological Polar Surface Area:55.8
Heavy Atom Count:16
Complexity:251
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Methyl 2-hydroxy-3-methoxy-5-(2-propen-1-yl)benzoate

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

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