Cas no 103906-12-3 (2-Naphthalenecarboxylicacid, 5-amino-6-hydroxy-)
103906-12-3 structure
Product Name:2-Naphthalenecarboxylicacid, 5-amino-6-hydroxy-
CAS No:103906-12-3
MF:C11H9NO3
MW:203.194062948227
CID:125930
PubChem ID:57357290
Update Time:2025-04-18
2-Naphthalenecarboxylicacid, 5-amino-6-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 2-Naphthalenecarboxylicacid, 5-amino-6-hydroxy-
- 2-Naphthoicacid,5-amino-6-hydroxy-(6CI)
- 5-amino-6-hydroxynaphthalene-2-carboxylic acid
- DTXSID50723616
- 5-amino-6-hydroxy-2-naphthoic acid
- 103906-12-3
- 1-amino-2-hydroxy-6-carboxynaphthalene
-
- Inchi： 1S/C11H9NO3/c12-10-8-3-1-7(11(14)15)5-6(8)2-4-9(10)13/h1-5,13H,12H2,(H,14,15)
- InChI Key： DMHFJUOUZWANGM-UHFFFAOYSA-N
- SMILES： OC1=CC=C2C=C(C(=O)O)C=CC2=C1N
Computed Properties
- Exact Mass: 203.058243149g/mol
- Monoisotopic Mass: 203.058243149g/mol
- 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: 83.6?2
- Surface Charge: 0
- Tautomer Count: 17
- XLogP3: 1.7
Experimental Properties
- PSA: 83.55000
- LogP: 2.40700
2-Naphthalenecarboxylicacid, 5-amino-6-hydroxy- Related Literature
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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