Chemical Properties of 3-Methoxy-2-nitrobenzoic acid (CAS 4920-80-3)

3-Methoxy-2-nitrobenzoic acid

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InChI
InChI=1S/C8H7NO5/c1-14-6-4-2-3-5(8(10)11)7(6)9(12)13/h2-4H,1H3,(H,10,11)
InChI Key
YMOMYSDAOXOCID-UHFFFAOYSA-N
Formula
C8H7NO5
SMILES
COc1cccc(C(=O)O)c1[N+](=O)[O-]
Molecular Weight1
197.14
CAS
4920-80-3
Other Names
  • 2-Nitro-3-methoxybenzoic acid
  • Benzoic acid, 3-methoxy-2-nitro-
  • m-Anisic acid, 2-nitro-
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Physical Properties

Property Value Unit Source
Δf -225.56 kJ/mol Joback Calculated Property
Δfgas -402.65 kJ/mol Joback Calculated Property
Δfus 27.98 kJ/mol Joback Calculated Property
Δsub 141.90 ± 1.30 kJ/mol NIST
Δvap 79.43 kJ/mol Joback Calculated Property
log10WS -2.30 Crippen Calculated Property
logPoct/wat 1.302 Crippen Calculated Property
McVol 130.550 ml/mol McGowan Calculated Property
Pc 4244.08 kPa Joback Calculated Property
Tboil 739.39 K Joback Calculated Property
Tc 966.92 K Joback Calculated Property
Tfus 507.97 K Joback Calculated Property
Vc 0.500 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [336.61; 376.02] J/mol×K [739.39; 966.92] Show Hide
Cp,gas 336.61 J/mol×K 739.39 Joback Calculated Property
Cp,gas 344.79 J/mol×K 777.31 Joback Calculated Property
Cp,gas 352.32 J/mol×K 815.23 Joback Calculated Property
Cp,gas 359.20 J/mol×K 853.16 Joback Calculated Property
Cp,gas 365.43 J/mol×K 891.08 Joback Calculated Property
Cp,gas 371.04 J/mol×K 929.00 Joback Calculated Property
Cp,gas 376.02 J/mol×K 966.92 Joback Calculated Property
ΔsubH 136.60 ± 1.30 kJ/mol 404.00 NIST

Similar Compounds

3-Methoxy-4-nitrobenzoic acid. Benzoic acid, 4-methoxy-3-nitro-. Lycoramine. Triamcinolone Acetonide. Triamcinolone diacetate. Fluoroglycofen ethyl ester. 2-Amino-1-propanol, ferrocenylboronate. Glyburide. m-Methoxybenzoic acid, 5-fluoro-2-nitrophenyl ester. Actinodaphnine. Benzoic acid, 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-, ethyl ester. Benzoic acid, (4-methoxy-3-nitrophenyl)methyl ester. Carteolol hydroxy, acetylated. 6H-Benzofuro[3a,3,2-ef][2]benzazepin-6-one, 4a,5,9,10,11,12-hexahydro-3-methoxy-11-methyl-, (4aS,8aS)-. «delta»1-tetrahydrocannabinolic acid, TMS.

Find more compounds similar to 3-Methoxy-2-nitrobenzoic acid.

Sources

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