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5-Methoxy-2,4-dinitrophenol

HCID 266795
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
51652-35-8
Standard SMILES
COc1cc(O)c([N+](=O)[O-])cc1[N+](=O)[O-]
InChIKey
IASWEPJOUWXONE-UHFFFAOYSA-N
Molecular formula
C7H6N2O6
Average molar mass
214.13 g/mol
Monoisotopic mass
214.02258591

Names & identifiers

Preferred name
5-Methoxy-2,4-dinitrophenol
IUPAC
5-methoxy-2,4-dinitrophenol
English name
5-METHOXY-2,4-DINITROPHENOL
Molecular formula
C7H6N2O6
Molecular weight
214.13

Names & synonyms

5-Methoxy-2,4-dinitrophenol51652-35-8Phenol,5-methoxy-2,4-dinitro-Phenol, 5-methoxy-2,4-dinitro-NSC105592SCHEMBL9005383DTXSID20295799IASWEPJOUWXONE-UHFFFAOYSA-NAKOS016009881NSC-105592DB-007068ST51035790
Show more names
2,4-DINITRO-5-METHOXYPHENOL5-Methoxy-2,4-dinttrophenol

Database identifiers

CAS
51652-35-8
PubChem CID
266795
DTXSID
DTXSID20295799
Nikkaji
J911.019D

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
121 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
1
Heavy atoms
15
Formal charge
0
Complexity
259

Physicochemical properties

Melting point
107 · 107-109
Risk Statements
20 · 20/21/22
Safety Statements
26 · 26-36/37/39

Safety & regulation

Safety data

risk_code
20/21/22
safety_code
26-36/37/39

Chemistry & industry

Suppliers7 total

武汉易泰科技有限公司上海分公司18930552037 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
南京克罗托鲁宁医药科技有限公司13382066392
郑州艾克姆化工有限公司13303867194 · [email protected]
重庆卡兰医药有限公司[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]

Related reactions

7 records
New reaction record
HRID 36435 reaction equation
HRID 36435As productuspto-grants-1995_05
HRID 36437 reaction equation
HRID 36437As reactantuspto-grants-1995_05
HRID 120045 reaction equation
HRID 120045As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 319167 reaction equation
HRID 319167As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 2211333 reaction equation
HRID 2211333As productuspto-grants-1995_10
HRID 2211334 reaction equation
HRID 2211334As reactantuspto-grants-1995_10
HRID 2340269 reaction equation
HRID 2340269As 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