[3-(Ethylthio)phenyl]boronic acid

HCID 3484915
NotesReactions

Completing data — usually done within a minute

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Basic information

CAS
870718-05-1
Standard SMILES
CCSc1cccc(B(O)O)c1
InChIKey
CZODYJDCHKOBID-UHFFFAOYSA-N
Molecular formula
C8H11BO2S
Average molar mass
182.05 g/mol

Names & identifiers

Preferred name
[3-(Ethylthio)phenyl]boronic acid
IUPAC
(3-ethylsulfanylphenyl)boronic acid

Names & synonyms

870718-05-1(3-(Ethylthio)phenyl)boronic acid[3-(ethylthio)phenyl]boronic acidRefChem:2074703-Ethylthiophenylboronic acid3-(Ethylthio)phenylboronic acid(3-ethylsulfanylphenyl)boronic AcidMFCD030929303-EthylthiophenylboronicacidSCHEMBL852507SCHEMBL299523043-(Ethylthio)benzeneboronic acid
Show more names
(3-(Ethylthio)phenyl)boronicacidCZODYJDCHKOBID-UHFFFAOYSA-NAKOS015949569AB13167Boronic acid,b-[3-(ethylthio)phenyl]-BS-25829SY025105CS-0007632

Database identifiers

CAS
870718-05-1
PubChem CID
3484915
EC Number
624-664-1

Properties

Computed structural propertiesFilling in

Topological polar surface area
65.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
12

Safety & regulation

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 100% (38 of 38) of all reports.

Not Classified

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesNot Classified

Chemistry & industry

Suppliers23 total

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]

Related reactions

4 records
New reaction record

Compound notes

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