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4-Tert-butyl-2,6-dichlorophenol

HCID 36864
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
34593-75-4
Standard SMILES
CC(C)(C)c1cc(Cl)c(O)c(Cl)c1
InChIKey
RETRALMQVUXTPQ-UHFFFAOYSA-N
Molecular formula
C10H12Cl2O
Average molar mass
219.1 g/mol
Monoisotopic mass
218.0265204

Names & identifiers

Preferred name
4-Tert-butyl-2,6-dichlorophenol
IUPAC
4-tert-butyl-2,6-dichlorophenol
English name
4-tert-Butyl-2,6-dichlorophenol
Molecular formula
C{10}H{12}Cl{2}O
Molecular weight
0

Names & synonyms

4-Tert-butyl-2,6-dichlorophenol34593-75-4DTXSID20188157NSC 407752RefChem:296376DTXCID501106484-(tert-butyl)-2,6-dichlorophenolMFCD18430815NSC407752SCHEMBL6321690SCHEMBL6321695RETRALMQVUXTPQ-UHFFFAOYSA-N
Show more names
NSC-407752SY3161404-TERT-BUTYL-2,6-DICHLORO-PHENOL2,6-Dichloro-4-(1,1-dimethylethyl)phenolDB-2632672,6-dichloro-4-(1,1-dimethylethyl) phenolNS00132810F87957

Database identifiers

CAS
34593-75-4
PubChem CID
36864
DTXSID
DTXSID20188157
EC Number
803-574-8
Nikkaji
J1.617.976K

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
164

Physicochemical properties

Symbol(GHS)
5 · GHS05
Signal word
Danger
Hazard statements
318 · H318
Precautionary statements
280 · P280-P305+P351+P338-P310

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

H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

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

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

Hazard information

Hazard Classes and CategoriesEye Dam. 1 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS05
Hazard statements
H318
Precautionary statements
P280-P305+P351+P338-P310

Chemistry & industry

Suppliers5 total

安徽合诺生物科技有限公司0555-2761852
上海超岚化工科技中心QQ:65489617 13301690235 · [email protected]
上海康恩博医药科技有限公司(科小研试剂)400-1388-521 17510465506 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

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Compound notes

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