Cas no 125328-79-2 (1H-Indol-3-ol,5-bromo-4-chloro-, dihydrogen phosphate (ester), calcium salt (1:1) (9CI))
125328-79-2 structure
Product Name:1H-Indol-3-ol,5-bromo-4-chloro-, dihydrogen phosphate (ester), calcium salt (1:1) (9CI)
CAS No:125328-79-2
MF:C8H4BrCaClNO4P
MW:364.530420303345
CID:197248
PubChem ID:44153832
Update Time:2025-04-19
1H-Indol-3-ol,5-bromo-4-chloro-, dihydrogen phosphate (ester), calcium salt (1:1) (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indol-3-ol,5-bromo-4-chloro-, dihydrogen phosphate (ester), calcium salt (1:1) (9CI)
- calcium,(5-bromo-4-chloro-1H-indol-3-yl) phosphate
- Calcium 5-bromo-4-chloro-1H-indol-3-yl phosphate
- DTXSID60925083
- 1H-Indol-3-ol, 5-bromo-4-chloro-, dihydrogen phosphate (ester), calcium salt (1:1)
- 125328-79-2
-
- Inchi： 1S/C8H6BrClNO4P.Ca/c9-4-1-2-5-7(8(4)10)6(3-11-5)15-16(12,13)14;/h1-3,11H,(H2,12,13,14);/q;+2/p-2
- InChI Key： DWEFICANZJQYTF-UHFFFAOYSA-L
- SMILES： BrC1C=CC2=C(C=1Cl)C(=CN2)OP(=O)([O-])[O-].[Ca+2]
Computed Properties
- Exact Mass: 362.838
- Monoisotopic Mass: 362.838
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 303
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 88.2A^2
Experimental Properties
- PSA: 98.02000
- LogP: 3.93170
1H-Indol-3-ol,5-bromo-4-chloro-, dihydrogen phosphate (ester), calcium salt (1:1) (9CI) 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
-
Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
-
Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
-
Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
125328-79-2 (1H-Indol-3-ol,5-bromo-4-chloro-, dihydrogen phosphate (ester), calcium salt (1:1) (9CI)) Related Products
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
- 2034271-14-0(2-(1H-indol-3-yl)-N-{[6-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}acetamide)
Recommended suppliers
Hunan Well Medicine Synthesis Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Shanghai Pearlk Chemicals Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shandong Feiyang Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
鉅瀾化工科技(青島)有限公司
Gold Member
Audited Supplier
CN Supplier
Bulk
Enjia Trading Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
