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Hexahydrophthalic Anhydride
CAS: 85-42-7 | C8H10O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
85-42-7
Molecular Formula:
C8H10O3
Molecular Mass:
154.16 g/mol
Names and Synonyms:
Hexahydrophthalic Anhydride
1,3-Isobenzofurandione, hexahydro-
1,2-Cyclohexanedicarboxylic anhydride
Hexahydro-1,3-isobenzofurandione
Hexahydrophthalic anhydride
Araldite HT 907
Lekutherm Hardener H
HHPA
Hexahydrophthalic acid anhydride
1,2-Cyclohexanedicarboxylic acid anhydride
Rikacid HH
Epilox H 11-01
Araldite HT 904
Rikacid HH-A
Araldite HY 907
Cyclohexanedicarboxylic anhydride
Rutapox HX
Rikacid HHPA
Araldite HY 925
Araldite Hardener HY 925
HY 925
Rutadur AG
NSC 8622
Rikacid MH 700E
MH 700E
HT 907
EP 400B
Aradur HY 925
Hexahydro-2-benzofuran-1,3-dione
Cyclohexane-1,2-dicarboxylic acid anhydride
Rikacid MH 600
Hardener HY 925
HV 136
MY 1832
Identifiers:
SMILES:
O=C1OC(=O)C2CCCCC12
InChI:
InChI=1S/C8H10O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h5-6H,1-4H2
Key Properties
Boiling Point
146 °C @ Press: 15 Torr
CAS Common Chemistry
Melting Point
32 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 154.16 g/mol | CAS Common Chemistry |
| 154.165 g/mol | RDKit | |
| 154.06299417999998 g/mol | RDKit | |
| Boiling Point | 146 °C @ Press: 15 Torr | CAS Common Chemistry |
| Canonical SMILES | O=C1OC(=O)C2CCCCC12 | CAS Common Chemistry |
| InChI | InChI=1S/C8H10O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h5-6H,1-4H2 | CAS Common Chemistry |
| InChI Key | InChIKey=MUTGBJKUEZFXGO-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 32 °C | CAS Common Chemistry |
| Name | Hexahydrophthalic anhydride | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 43.370000000000005 Ų | RDKit |
| LogP | 0.8761999999999999 | RDKit |
| Molar Refractivity | 36.547000000000004 | RDKit |
