Cas no 861774-96-1 (Phenol, 3,4-diamino-2-methoxy-)
861774-96-1 structure
Product Name:Phenol, 3,4-diamino-2-methoxy-
CAS No:861774-96-1
MF:C7H10N2O2
MW:154.166501522064
CID:1844286
PubChem ID:76851179
Update Time:2025-04-21
Phenol, 3,4-diamino-2-methoxy- Chemical and Physical Properties
Names and Identifiers
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- Phenol, 3,4-diamino-2-methoxy-
- 861774-96-1
- Phenol,3,4-diamino-2-methoxy-
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- Inchi： 1S/C7H10N2O2/c1-11-7-5(10)3-2-4(8)6(7)9/h2-3,10H,8-9H2,1H3
- InChI Key： ZFGQXDMIEVJXLW-UHFFFAOYSA-N
- SMILES： O(C)C1C(=CC=C(C=1N)N)O
Computed Properties
- Exact Mass: 154.074227566g/mol
- Monoisotopic Mass: 154.074227566g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 132
- 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: 0.2
- Topological Polar Surface Area: 81.5?2
Phenol, 3,4-diamino-2-methoxy- Related Literature
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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