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Methyl 2-ethoxybenzoate

Methyl 2-ethoxybenzoate structure

CAS No:
3686-55-3
Formula:
C10H12O3
Chemical Name:
Methyl 2-ethoxybenzoate
Synonyms:
Benzoic acid,2-ethoxy-,methyl ester;Benzoic acid,o-ethoxy-,methyl ester;Methyl 2-ethoxybenzoate;Methyl o-ethoxybenzoate;R 172;NSC 406652;2-Ethoxy-benzoic acid methyl ester
Categories:
Pharmaceutical Intermediates > Ophthalmic Agents

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Methyl 2-ethoxybenzoate Basic Attributes

Molecular Weight：

180.201

Exact Mass：

180.20

EC Number：

609-301-7

NSC Number：

406652

DSSTox ID：

DTXSID90324409

HScode：

2918990090

Characteristics

PSA：

35.53000

XLogP3：

2.57

Density：

1.1535 g/cm³ @ Temp: 20 °C

Boiling Point：

120-121 °C @ Press: 5 Torr

Flash Point：

102.1±14.4 °C

Refractive Index：

1.500

Safety Information

Packing level：

III

Hazard category：

6.1(b)

Transport codes：

UN 2449

hazard class code：

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .

safety instructions：

S36

Computed Properties

Molecular Weight:180.20
XLogP3:2.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:180.078644241
Monoisotopic Mass:180.078644241
Topological Polar Surface Area:35.5
Heavy Atom Count:13
Complexity:168
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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