Chemical Properties of Carbofurane (CAS 1563-66-2)

Carbofurane

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)
InChI Key
DUEPRVBVGDRKAG-UHFFFAOYSA-N
Formula
C12H15NO3
SMILES
CNC(=O)Oc1cccc2c1OC(C)(C)C2
Molecular Weight1
221.25
CAS
1563-66-2
Other Names
  • 2,2-Dimethyl-2,2-dihydrobenzofuranyl-7 N-methylcarbamate
  • 2,2-Dimethyl-2,3-dihydro-7-benzofuranyl N-methylcarbamate
  • 2,2-Dimethyl-2,3-dihydrobenzoduranyl-7-N-methylcarbamate
  • 2,2-Dimethyl-7-Coumaranyl N-methylcarbamate
  • 2,3-Dihydro-2,2-dimethyl-7-benzofuranol methylcarbamate
  • 2,3-Dihydro-2,2-dimethyl-7-benzofuranyl methylcarbamate
  • 2,3-Dihydro-2,2-dimethylbenzofuran-7-yl methylcarbamate
  • 2,3-Dihydro-2,2-dimethylbenzofuranyl-7-N-methylcarbamate
  • 7-Benzofurano, 2,3-dihydro-2,2-dimethyl, methylcarbamate
  • 7-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, 7-(N-methylcarbamate)
  • 7-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, methylcarbamate
  • BAY 70143
  • BAY 78537
  • Benzofuran-7-ol, 2,3-dihydro, 2,2-dimethyl, N-methylcarbamate
  • C2292-59a
  • Carbamic acid, methyl-, 2,2-dimethyl-2,3-dihydro-7-benzofuranyl ester
  • Carbamic acid, methyl-, 2,2-dimethyl-2,3-dihydrobenzofuran-7-yl ester
  • Carbamic acid, methyl-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester
  • Carbodan
  • Chinufur
  • Crisfuran
  • Curaterr
  • D 1221
  • ENT 27,164
  • FMC 10242
  • Furacarb
  • Furadan
  • Furadan 3G
  • Furadan 4F
  • Furadan 75 WP
  • Furadan G
  • Furadane
  • Karbofuranu
  • Me f248
  • Methyl carbamic acid 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester
  • NA 2757
  • NIA 10242
  • Niagara 10242
  • Niagara nia-10242
  • OMS 864
  • Rampart
  • Yaltox
Sources

Physical Properties

Property Value Unit Source
Δf -32.08 kJ/mol Joback Calculated Property
Δfgas -312.71 kJ/mol Joback Calculated Property
Δfus 27.80 kJ/mol Joback Calculated Property
Δvap 64.77 kJ/mol Joback Calculated Property
logPoct/wat 2.12 Crippen Calculated Property
Pc 2940.89 kPa Joback Calculated Property
Tboil 670.99 K Joback Calculated Property
Tc 898.37 K Joback Calculated Property
Tfus 426.38 ± 0.20 K NIST
Vc 0.63 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 455.84 J/mol×K 670.99 Joback Calculated Property
ΔfusH 30.33 kJ/mol 426.2 NIST

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-O- (ring) 1
>C=O (nonring) 1
=CH- (ring) 3
=C< (ring) 3
>NH 1
>C< (ring) 1
-CH3 3
-CH2- (ring) 1

Similar Compounds

Carbosulfan. 3-Hydroxycarbofuran. Carbofuran 3-keto. 7-Benzofuranol, 2,3-dihydro-2,2-dimethyl-. 3,7-Benzofurandiol, 2,3-dihydro-2,2-dimethyl-. 3(2H)-Benzofuranone, 7-hydroxy-2,2-dimethyl-. Benzofuran, 2,3-dihydro-2,2,6-trimethyl-. Benzofuran, 2,3-dihydro-2,2,4,6-tetramethyl-. Benzofuran deriv (herz). Benzofuran, 2,3-dihydro-2,2,7-trimethyl-. 2,5-Dimethoxy-4-methyl-.beta.-phenethylamine-M (OH-), diacetylated. (S)-5-Allyl-1,3-dimethoxy-2-((1-(3,4,5-trimethoxyphenyl)propan-2-yl)oxy)benzene. (S)-5-Allyl-2-((1-(3,4-dimethoxyphenyl)propan-2-yl)oxy)-1,3-dimethoxybenzene. 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (HO-desamino-COOH), isomer 2, methyl-acetylated. (1S,2R)-2-(4-Allyl-2-methoxyphenoxy)-1-(3,4,5-trimethoxyphenyl)propan-1-ol.

Find more compounds similar to Carbofurane.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.