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2,3-dihydro-1H-indol-5-ol

HCID 10034684
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
172078-33-0
Standard SMILES
Oc1ccc2c(c1)CCN2
InChIKey
MPCXQPXCYDDJSR-UHFFFAOYSA-N
Molecular formula
C8H9NO
Average molar mass
135.16 g/mol
Monoisotopic mass
135.06841391

Names & identifiers

Preferred name
2,3-dihydro-1H-indol-5-ol
IUPAC
2,3-dihydro-1H-indol-5-ol
English name
2,3-Dihydroindol-5-ol
Molecular formula
C8H9NO
Molecular weight
135.16

Names & synonyms

172078-33-02,3-dihydro-1H-indol-5-olDTXSID40434426RefChem:81667DTXCID90385252Indolin-5-ol2,3-Dihydroindol-5-olMFCD02181134CHEMBL193315-hydroxyindolineSCHEMBL59263SCHEMBL3279456
Show more names
2,3-Dihydroindol-5-ol HCl1H-INDOL-5-OL, 2,3-DIHYDRO-
SCHEMBL9404755SCHEMBL108482632,3-dihydro-1 H-indol-5-olMPCXQPXCYDDJSR-UHFFFAOYSA-N5-hydroxy-2,3-dihydro-1H-indoleBDBM50291681AKOS006279674CS-W007244

Database identifiers

CAS
172078-33-0
PubChem CID
10034684
DTXSID
DTXSID40434426
ChEMBL
CHEMBL19331
Nikkaji
J2.362.516D

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
32.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
10
Formal charge
0
Complexity
126

Physicochemical properties

Boiling point
322.2 · 322.2±31.0 °C(Predicted)
Density
1.196 · 1.196±0.06 g/cm3(Predicted)
storage temp.
-20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
pka
11.47 · 11.47±0.20(Predicted)
HS Code
2933998090 · 2933998090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2933998090

Chemistry & industry

Upstream & downstream products

Upstream raw materials

5-HydroxyindoleSodium hydroxide

Downstream products

N-Boc-5-hydroxyindoline

Suppliers30 total

杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
河南赢创生物科技有限公司15672878902 · [email protected]
上海孚一生物科技有限公司+86 (21) 61124340
赛诺威(厦门)科技有限公司请加微信(同手机号)或QQ询价 13876246362 · [email protected]
上海药禾平生物医药科技有限公司57540919 13120888836 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
泰安市嘉叶生物科技有限公司15318151873;13127280945 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
苏州诺欧曼生物科技有限公司15026866316 · [email protected]
上海珂华生物科技有限公司021-58581007 18019463053 · [email protected]
偶极医药科技(徐州)有限公司18860422096 15056790731
沈阳莫德医药科技有限公司024-23982345 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
云南博泉金属材料有限公司13160237726 13160237726 · [email protected]
常州瑞清医药科技有限公司0519-85859396 15380475813;15380475813 · [email protected]
JACS-郑州杰克斯化工产品有限公司0371-86259281 13223061139 · [email protected]
上海锐谱医药科技有限公司15895968936 · [email protected]
湖北偕丰医药科技有限公司2383948258 19172820304 · [email protected]
Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]

Related reactions

5 records
New reaction record
HRID 454191 reaction equation
HRID 454191As productuspto-grants-2013_07
HRID 1640256 reaction equation
HRID 1640256As productuspto-grants-2012_02
HRID 1640273 reaction equation
HRID 1640273As reactantuspto-grants-2012_02
HRID 1791716 reaction equation
HRID 1791716As productuspto-grants-2006_07
HRID 2123081 reaction equation
HRID 2123081As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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