Cas no 5307-00-6 (1,4-Benzenediamine,2-methoxy-5-methyl-)
5307-00-6 structure
Product Name:1,4-Benzenediamine,2-methoxy-5-methyl-
1,4-Benzenediamine,2-methoxy-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Benzenediamine,2-methoxy-5-methyl-
- 2-methoxy-5-methylbenzene-1,4-diamine
- 4-AMINO-2-METHOXY-5-METHYLANILINE
- NS00122910
- 2-methyl-5-methoxy paraphenylenediamine
- UNII-HXB8JN17JU
- AMINO-2-METHOXY-5-METHYLANILINE, 4-
- AKOS006278043
- NSC 36994
- NSC36994
- CCRIS 8121
- NSC-36994
- Toluene-2,5-diamine, 4-methoxy-
- HXB8JN17JU
- 2-methoxy-5-methyl-1,4-diaminobenzene
- 4-methoxytoluene-2,5-diamine
- SCHEMBL525676
- DTXSID90201145
- 2-methyl 5-methoxy paraphenylenediamine
- Q27280145
- 5307-00-6
- KNRVAYVZVIKHHL-UHFFFAOYSA-N
-
- Inchi: 1S/C8H12N2O/c1-5-3-7(10)8(11-2)4-6(5)9/h3-4H,9-10H2,1-2H3
- InChI Key: KNRVAYVZVIKHHL-UHFFFAOYSA-N
- SMILES: O(C)C1=CC(=C(C)C=C1N)N
Computed Properties
- Exact Mass: 152.09506
- Monoisotopic Mass: 152.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 129
- 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
- XLogP3: 0.9
- Topological Polar Surface Area: 61.3?2
Experimental Properties
- Density: 1.133
- Boiling Point: 308.3°Cat760mmHg
- Flash Point: 160.3°C
- Refractive Index: 1.604
- PSA: 61.27
1,4-Benzenediamine,2-methoxy-5-methyl- Related Literature
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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