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5-Hydroxymethyl-2-furoicacidmethylester

5-Hydroxymethyl-2-furoicacidmethylester structure

CAS No:
36802-01-4
Formula:
C7H8O4
Chemical Name:
5-Hydroxymethyl-2-furoicacidmethylester
Synonyms:
5-Hydroxymethyl-2-furoic acid methyl ester;methyl 5-(hydroxymethyl)-2-furoate(SALTDATA: FREE);Methyl 5-(hydroxymethyl)furan-2-carboxylate;2-Furancarboxylic acid, 5-(hydroxyMethyl)-, Methyl ester

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5-Hydroxymethyl-2-furoicacidmethylester Basic Attributes

Molecular Weight：

156.14

Exact Mass：

156.04225873

DSSTox ID：

DTXSID50508425

HScode：

2932190090

Characteristics

PSA：

59.67000

XLogP3：

0.55850

Density：

1.259±0.06 g/cm3

Melting Point：

20 °C

Boiling Point：

146 °C(Press: 29 Torr)

PKA：

12.54±0.10

Safety Information

Hazard category：

IRRITANT

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:156.14
XLogP3:0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:156.04225873
Monoisotopic Mass:156.04225873
Topological Polar Surface Area:59.7
Heavy Atom Count:11
Complexity:145
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Hydroxymethyl-2-furoicacidmethylester

Basic Attributes
Characteristics
Safety Information
Computed Properties

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