Cas no 7410-40-4 ( )
structure
Product Name:
CAS No:7410-40-4
MF:C12H11N3OS
MW:245.300240755081
CID:979042
PubChem ID:135400403
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- [[(Z)-(2-oxonaphthalen-1-ylidene)methyl]amino]thiourea
- 2-HYDROXY-1-NAPHTHALDEHYDE THIOSEMICARBAZONE
- 2-hydroxy-1-naphthaldehydenehydrazinecarbothioami
- 2-hydroxy-1-naphthalidene thiosemicarbazone
- 2-hydroxy-1-naphthalidine-thiosemicarmazone
- 2-hydroxynaphthalene-1-carbaldehyde thiosemicarbazone
- AC1NTH95
- ARONIS019256
- CBDivE_001140
- CHEMBL505209
- F3111-2829
- NSC110693
- STOCK1S-57977
- thiosemicarbazone of 2-hydroxy-1-naphthaldehyde
- thiosemicarbazone of 2-hydroxynaphthaldehyde
- F0880-0006
- (E)-2-((2-hydroxynaphthalen-1-yl)methylene)hydrazinecarbothioamide
- F0777-0544
- MLS000777669
- [(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]thiourea
- EN300-235824
- DTXSID00419032
- SR-01000009751
- 2-((2-hydroxynaphthalen-1-yl)methylene)hydrazine-1-carbothioamide
- N'-[(1Z)-(2-HYDROXY-1-NAPHTHYL)METHYLENE]CARBAMOHYDRAZONOTHIOIC ACID
- SMR000414063
- AKOS000486109
- NSC-110693
- [(E)-[(2-HYDROXYNAPHTHALEN-1-YL)METHYLIDENE]AMINO]THIOUREA
- 1335024-24-2
- 2-hydroxy-naphthaldehyde thiosemicarbazone
- 7410-40-4
- SR-01000009751-1
- STK093313
- (2E)-2-[(2-hydroxynaphthalen-1-yl)methylidene]hydrazinecarbothioamide
-
-
- Inchi： 1S/C12H11N3OS/c13-12(17)15-14-7-10-9-4-2-1-3-8(9)5-6-11(10)16/h1-7,16H,(H3,13,15,17)/b14-7+
- InChI Key： INVDVNVYLCEPSF-VGOFMYFVSA-N
- SMILES： S=C(N)N/N=C/C1C(=CC=C2C=CC=CC2=1)O
Computed Properties
- Exact Mass: 245.06243
- Monoisotopic Mass: 245.062
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 389
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 99.2A^2
- XLogP3: 2.1
Experimental Properties
- Density: 1.446
- Boiling Point: 465.9°C at 760 mmHg
- Flash Point: 235.6°C
- Refractive Index: 1.787
- PSA: 67.15
- LogP: 2.80370
Related Literature
-
Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
-
2. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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