Cas no 165185-23-9 (1-Naphthalenecarboxylicacid, 3-amino-4-hydroxy-)
165185-23-9 structure
Product Name:1-Naphthalenecarboxylicacid, 3-amino-4-hydroxy-
CAS No:165185-23-9
MF:C11H9NO3
MW:203.194062948227
CID:110540
PubChem ID:45089646
Update Time:2025-04-18
1-Naphthalenecarboxylicacid, 3-amino-4-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 1-Naphthalenecarboxylicacid, 3-amino-4-hydroxy-
- 3-amino-4-hydroxynaphthalene-1-carboxylic acid
- 1-Naphthalenecarboxylicacid,3-amino-4-hydroxy-(9CI)
- 165185-23-9
- 3-Amino-4-hydroxy-1-naphthoic acid
- DTXSID30666512
- SCHEMBL6036418
-
- Inchi： 1S/C11H9NO3/c12-9-5-8(11(14)15)6-3-1-2-4-7(6)10(9)13/h1-5,13H,12H2,(H,14,15)
- InChI Key： DZZSVBQUFJJMCG-UHFFFAOYSA-N
- SMILES： OC1C(=CC(C(=O)O)=C2C=CC=CC2=1)N
Computed Properties
- Exact Mass: 203.05827
- Monoisotopic Mass: 203.058
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 256
- 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: 83.6A^2
- XLogP3: 1.7
Experimental Properties
- PSA: 83.55
1-Naphthalenecarboxylicacid, 3-amino-4-hydroxy- Related Literature
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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