Basic information
- CAS
202197-31-7- Standard SMILES
Nc1ccc2c(cnn2Cc2cccc(F)c2)c1- InChIKey
BTNPJMNKYNWUPD-UHFFFAOYSA-N- Molecular formula
- C14H12FN3
- Average molar mass
- 241.26 g/mol
- Monoisotopic mass
- 241.1015256
Names & identifiers
- Preferred name
- 1-(3-Fluorobenzyl)-1H-indazol-5-amine
- IUPAC
- 1-[(3-fluorophenyl)methyl]indazol-5-amine
- English name
- 5-Amino-1-(3-fluorobenzyl)indazole
- Molecular formula
- C14H12FN3
- Molecular weight
- 241.26
Names & synonyms
202197-31-71-(3-FLUOROBENZYL)-1H-INDAZOL-5-AMINE1-[(3-fluorophenyl)methyl]indazol-5-amine5-AMINO-1-(3-FLUOROBENZYL)INDAZOLE1-[(3-fluorophenyl)methyl]-1H-indazol-5-amine1H-Indazol-5-amine, 1-[(3-fluorophenyl)methyl]-MFCD080612591-(3-fluoro-benzyl)-1H-indazol-5-ylamine1-(3-fluorobenzyl)-1H-indazole-5-amineSCHEMBL215702SCHEMBL5665244SCHEMBL30729935
Show more names
1045001-[(3-fluorophenyl)methyl]-1H-indazol-5-amine - [F22202]
DTXSID10428054BTNPJMNKYNWUPD-UHFFFAOYSA-NAKOS0159178805-amino-1-N-(3-fluorobenzyl)indazoleSB163011-(3-fluorobenzyl)-1H-indazol 5-amine1-(3-flurobenzyl)-1H-indazol-5-ylamineAS-44214
Database identifiers
- CAS
202197-31-7- PubChem CID
- 7147073
- DTXSID
DTXSID10428054- Nikkaji
- J2.339.839G
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 286
Physicochemical properties
- Boiling point
- 438.1 · 438.1±30.0 °C(Predicted)
- Density
- 1.28 · 1.28±0.1 g/cm3(Predicted)
- pka
- 3.71 · 3.71±0.10(Predicted)
Chemistry & industry
Suppliers17 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
无锡捷化医药科技有限公司0510-83588313-811 18800520310 · [email protected]
CEG Chemical Science & Technology Co., Ltd.Mobile:13665161512
上海兴默生物技术有限公司+86 13524779951; 13524779951
成都瑞欧克科技有限公司028-64353063 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
无锡凯德瑞医药科技有限公司19906241957 · [email protected]
河北唯特医药科技有限公司13180081292 13180081292 · [email protected]
无锡东禾医药科技有限公司63313187 15358055255 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
南京克罗托鲁宁医药科技有限公司
Related reactions
45 records
Compound notes
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