Cas no 1938-61-0 (4-Methylphthalic anhydride)
4-Methylphthalic anhydride structure
Product Name:4-Methylphthalic anhydride
CAS No:1938-61-0
MF:C9H6O3
MW:162.142142772675
CID:865059
Update Time:2023-08-03
4-Methylphthalic anhydride Chemical and Physical Properties
Names and Identifiers
-
- 4-methylphthalic anhydride
- 5-Methyl-2-benzofuran-1,3-dione
- 5-METHYLISOBENZOFURAN-1,3-DIONE
- 1,3-Isobenzofurandione, 5-methyl-
- Phthalic anhydride, 4-methyl-
- 2P2740FPCK
- ZOXBWJMCXHTKNU-UHFFFAOYSA-N
- DSSTox_CID_7805
- 5-methyl-1,3-dihydro-2-benzofuran-1,3-dione
- DSSTox_RID_78575
- DSSTox_GSID_27805
- 4methylphthalic anhydride
- 4-Methylphthalicanhydride
- 4-methyphthalic anhydride
- 4-Methylphthalic a
- 4-Methylphthalic anhydride
-
- Inchi： 1S/C9H6O3/c1-5-2-3-6-7(4-5)9(11)12-8(6)10/h2-4H,1H3
- InChI Key： ZOXBWJMCXHTKNU-UHFFFAOYSA-N
- SMILES： O1C(C2C=CC(C)=CC=2C1=O)=O
Computed Properties
- Exact Mass: 162.032
- Monoisotopic Mass: 162.032
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 234
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 43.4
Experimental Properties
- Color/Form: Yellow solid
- Density: 1.364
- Melting Point: 88-92℃
- Boiling Point: 295 °C at 760 mmHg
- Flash Point: 156.3 °C
- Refractive Index: 1.597
- PSA: 43.37000
- LogP: 1.30560
4-Methylphthalic anhydride Security Information
- Storage Condition：Store in tightly closed containers. Store in a cool, dry, well ventilated area away from incompatible substances. Avoid moisture.
4-Methylphthalic anhydride Related Literature
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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