Cas no 19031-59-5 (1-Naphthaleneacetic-a,a-d2 acid (8CI))
19031-59-5 structure
Product Name:1-Naphthaleneacetic-a,a-d2 acid (8CI)
CAS No:19031-59-5
MF:C12H10O2
MW:188.218926906586
CID:123319
PubChem ID:102602367
Update Time:2025-04-18
1-Naphthaleneacetic-a,a-d2 acid (8CI) Chemical and Physical Properties
Names and Identifiers
-
- 1-Naphthaleneacetic-a,a-d2 acid (8CI)
- 1-NAPHTHALENEACETIC-2,2-D2 ACID
- 2,2-Dideuterio-2-naphthalen-1-ylacetic acid
- 19031-59-5
-
- Inchi： 1S/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)/i8D2
- InChI Key： PRPINYUDVPFIRX-MGVXTIMCSA-N
- SMILES： OC(C([2H])([2H])C1C=CC=C2C=CC=CC=12)=O
Computed Properties
- Exact Mass: 188.080633049g/mol
- Monoisotopic Mass: 188.080633049g/mol
- Isotope Atom Count: 2
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 212
- 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: 2.7
- Topological Polar Surface Area: 37.3?2
1-Naphthaleneacetic-a,a-d2 acid (8CI) Related Literature
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Keerthi Prabhu,Shweta J. Malode,Raviraj M. Kulkarni,Nagaraj P. Shetti New J. Chem. 2023 47 315
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Utsav Garg,Yasser Azim,Aranya Kar,Chullikkattil P. Pradeep CrystEngComm 2020 22 2978
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Zongbao Chen,Zian Lin,Lin Zhang,Yan Cai,Lan Zhang Analyst 2012 137 1723
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Fenying Wang,Dan Wang,Tingting Wang,Yu Jin,Baoping Ling,Qianjin Li,Jianlin Li RSC Adv. 2021 11 7732
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Shizuka Saito-Shida,Satoru Nemoto,Hiroshi Akiyama Anal. Methods 2021 13 894
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