Cas no 1630-17-7 (Benzene,1,3-dimethyl-5-(4-nitrophenoxy)-)
1630-17-7 structure
Product Name:Benzene,1,3-dimethyl-5-(4-nitrophenoxy)-
CAS No:1630-17-7
MF:C14H13NO3
MW:243.257923841476
CID:151616
PubChem ID:15397
Update Time:2025-04-19
Benzene,1,3-dimethyl-5-(4-nitrophenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1,3-dimethyl-5-(4-nitrophenoxy)-
- 1,3-dimethyl-5-(4-nitrophenoxy)benzene
- DMNP
- Farmaid
- 1-(4-Nitrophenoxy)-3,5-dimethylbenzene
- 3,5-Dimethylphenyl(4-nitrophenyl) ether
- 5-(4-nitrophenoxy) m-xylene
- AKOS021982745
- Benzene, 1,3-dimethyl-5-(4-nitrophenoxy)-
- SCHEMBL1323759
- 1630-17-7
- DTXSID5075103
-
- Inchi: 1S/C14H13NO3/c1-10-7-11(2)9-14(8-10)18-13-5-3-12(4-6-13)15(16)17/h3-9H,1-2H3
- InChI Key: KEOPWKJOJXPFCA-UHFFFAOYSA-N
- SMILES: O(C1C=CC(=CC=1)[N+](=O)[O-])C1C=C(C)C=C(C)C=1
Computed Properties
- Exact Mass: 243.08959
- Monoisotopic Mass: 243.089543
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 271
- 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: 55
- XLogP3: 4
Experimental Properties
- Density: 1.19
- Boiling Point: 348.2°Cat760mmHg
- Flash Point: 143°C
- Refractive Index: 1.589
- PSA: 52.37
Benzene,1,3-dimethyl-5-(4-nitrophenoxy)- Related Literature
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
1630-17-7 (Benzene,1,3-dimethyl-5-(4-nitrophenoxy)-) Related Products
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