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5-Chloro-1H-pyrrolo(3,2-b)pyridine

HCID 12384237
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
65156-94-7
Standard SMILES
Clc1ccc2[nH]ccc2n1
InChIKey
RFPQVCYUKAYKEG-UHFFFAOYSA-N
Molecular formula
C7H5ClN2
Average molar mass
152.58 g/mol
Monoisotopic mass
152.01412584

Names & identifiers

Preferred name
5-Chloro-1H-pyrrolo(3,2-b)pyridine
IUPAC
5-chloro-1H-pyrrolo[3,2-b]pyridine
English name
5-Chloro-1H-pyrrolo[3,2-b] pyridine
Molecular formula
C7H5ClN2
Molecular weight
152.58

Names & synonyms

5-Chloro-1H-pyrrolo[3,2-b]pyridine65156-94-7DTXSID004956545-Chloro-1H-pyrrolo(3,2-b)pyridineRefChem:1072774DTXCID004464645-Chloro-4-azaindoleMFCD080625531H-Pyrrolo[3,2-b]pyridine, 5-chloro-SCHEMBL4214235-chloropyrrolo-[3,2-b]pyridinePB26323
Show more names
5-Chloro-1H-pyrrolo[3,2-b] pyridine5-cChloro-1H-pyrrolo[3,2-b]pyridine5-Chloro-4-azaindole,5-chloro-1H-pyrrolo[3,2-b]pyridine
SY030375BCP26427SCHEMBL21806950SCHEMBL29142026SCHEMBL30089364AKOS005258070CS-W0082845-Chloro-1H-pyrrolo [3,2-b]pyridine

Database identifiers

CAS
65156-94-7
PubChem CID
12384237
DTXSID
DTXSID00495654
EC Number
804-170-4

Properties

Computed structural properties

XLogP
2
Topological polar surface area
28.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
10
Formal charge
0
Complexity
129

Physicochemical properties

Boiling point
304.9 · 304.9±22.0 °C(Predicted)
Density
1.425 · 1.425±0.06 g/cm3(Predicted)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
form
solid
pka
13.75 · 13.75±0.40(Predicted)
Appearance
Light brown to yellow Solid
InChI
1S/C7H5ClN2/c8-7-2-1-5-6(10-7)3-4-9-5/h1-4,9H
InChIKey
RFPQVCYUKAYKEG-UHFFFAOYSA-N
SMILES
Clc1ccc2[nH]ccc2n1
UNSPSC Code
12352200 · 12352200
Symbol(GHS)
5 · GHS05,GHS07
Signal word
Danger
Hazard statements
302 · H302-H318
Precautionary statements
280 · P280-P301+P312+P330-P305+P351+P338+P310
Hazard Codes
Xi
WGK Germany
3 · 3
HazardClass
IRRITANT
HS Code
2933998090 · 2933998090
Storage Class
11 · 11 - Combustible Solids
Hazard Classifications
4 OralEye · Acute Tox. 4 OralEye Dam. 1

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

wgk
3
hs_code
2933998090
Signal word
Danger
Symbol(GHS)
GHS05,GHS07
hazard_code
Xi
hazard_class
IRRITANT
Storage Class
11 - Combustible Solids
Hazard statements
H302-H318
Hazard Classifications
Acute Tox. 4 OralEye Dam. 1
Precautionary statements
P280-P301+P312+P330-P305+P351+P338+P310

Chemistry & industry

Applications

Uses5-Chloro-1H-pyrrolo[3,2-B]pyridine can be used as an organic synthesis intermediate and a pharmaceutical intermediate, and is mainly used in laboratory research and development processes and chemical pharmaceutical production processes.

Upstream & downstream products

Upstream raw materials

3-Pyridinamine, 6-chloro-2-[(1E)-2-ethoxyethenyl]-3-Pyridinamine, 6-chloro-2-[2-(trimethylsilyl)ethynyl]-1H-Pyrrolo[3,2-b]pyridine, 5-chloro-1-[(4-methylphenyl)sulfonyl]-5H-Pyrrolo[3,2-b]pyridin-5-one(6-Chloro-3-nitro-pyridin-2-yl)-acetonitrile2-Bromo-6-chloropyridin-3-amine3-Amino-2-chloro-6-iodopyridine5-Amino-2-chloropyridineMethanolHydrochloric acid

Suppliers100 total

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海策嵘生物科技有限公司[email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
济南深丽康化工科技有限公司0531-86092839 15318817273 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
江苏弘和药物研发有限公司5108538618 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [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]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
Advanced chemblocks inc650-6922368 650-6922368;650-6922368 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
学研惠(武汉)科技有限公司15727060112 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
杭州东帆化学有限公司86-0571-85151182
上海舒盟医药科技有限公司021-54540637 18621091017 · [email protected]
同创医药(苏州)有限公司0512-63263366 18912765016 · [email protected]
河南多贝化工有限公司0370-2785118 17550508557 · [email protected]
武汉艾瑞尔化学科技有限公司18986259541 18986259541 · [email protected]
苏州思变化学技术有限公司0512-65617459 18915409046 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
台州南峰药物研究所[email protected] 18616377689 · [email protected]
上海仁曲医药科技有限公司18171398856 2968382473 · [email protected]
深圳康特腾科技有限公司86-0755-86635001 · [email protected]
越林试剂021-62960152 · [email protected]
上海睿升化工科技有限公司+86-021-50935922
武汉代为医药科技有限公司027-65318838 13646286950 · [email protected]
金瓯生物医药(南京)有限公司13000000000 · [email protected]
上海裕兰生物科技有限公司021-57171705 13817537615 · [email protected]
深圳市格物致欣化学技术有限公司13226079980 · [email protected]
CEG Chemical Science & Technology Co., Ltd.Mobile:13665161512
KARMEL TECHNOLOGY (HK) CO.,LIMITED+8618795957998 · [email protected]
上海将来实业股份有限公司021-61552785 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
上海驭远医药科技有限公司13052276172 · [email protected]
嘉兴诺华化工有限公司18957373295
上海嵩爰化工科技有限公司010-1234567 18521000990 · [email protected]
南京恰风和医药科技有限公司025-57018978 18251899859 · [email protected]
诺尔凯立科技有限公司86-(0)21-31261262 373522135 · [email protected]
斯派螺(武汉)药物研发有限公司[email protected]
深圳市大物科技有限责任公司0752-5555973 13923768523 · [email protected]
上海双锕化学科技有限公司15010167677 · [email protected]

Related reactions

7 records
New reaction record
HRID 628245 reaction equation
HRID 628245As reactantuspto-grants-2016_04
HRID 628248 reaction equation
HRID 628248As reactantuspto-grants-2016_04
HRID 628446 reaction equation
HRID 628446As reactantuspto-grants-2016_04
HRID 651650 reaction equation
HRID 651650As productuspto-grants-2001_08
HRID 1075569 reaction equation
HRID 1075569As reactantuspto-grants-1999_05
HRID 1529342 reaction equation
HRID 1529342As reactantuspto-grants-2015_07
HRID 2345089 reaction equation
HRID 2345089As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes