Cas no 735223-72-0 (1,4-Benzenediol, 2-amino-5-methoxy- (9CI))
735223-72-0 structure
Product Name:1,4-Benzenediol, 2-amino-5-methoxy- (9CI)
CAS No:735223-72-0
MF:C7H9NO3
MW:155.151262044907
CID:559597
Update Time:2024-03-05
1,4-Benzenediol, 2-amino-5-methoxy- (9CI) Chemical and Physical Properties
Names and Identifiers
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- 1,4-Benzenediol, 2-amino-5-methoxy- (9CI)
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- Inchi： 1S/C7H9NO3/c1-11-7-3-5(9)4(8)2-6(7)10/h2-3,9-10H,8H2,1H3
- InChI Key： LQPSDWSPVWMCSC-UHFFFAOYSA-N
- SMILES： C1(O)=CC(OC)=C(O)C=C1N
Computed Properties
- Exact Mass: 155.058
- Monoisotopic Mass: 155.058
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 131
- 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: 1
- Topological Polar Surface Area: 75.7A^2
1,4-Benzenediol, 2-amino-5-methoxy- (9CI) Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
735223-72-0 (1,4-Benzenediol, 2-amino-5-methoxy- (9CI)) Related Products
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