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3-(Difluoromethyl)-2-methylpyridine

HCID 18629366
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
335428-90-5
Standard SMILES
Cc1ncccc1C(F)F
InChIKey
BZUGYWBCHVCSCL-UHFFFAOYSA-N
Molecular formula
C7H7F2N
Average molar mass
143.13 g/mol
Monoisotopic mass
143.05465555

Names & identifiers

Preferred name
3-(Difluoromethyl)-2-methylpyridine
IUPAC
3-(difluoromethyl)-2-methylpyridine
English name
Pyridine, 3-(difluoromethyl)-2-methyl- (9CI)
Molecular formula
C7H7F2N
Molecular weight
143.1339864

Names & synonyms

3-(difluoromethyl)-2-methylpyridine335428-90-5Pyridine, 3-(difluoromethyl)-2-methyl-Pyridine, 3-(difluoromethyl)-2-methyl- (9CI)SCHEMBL1179915SCHEMBL2305623SCHEMBL254127973-difluoromethyl-2-methylpyridineZB0722DB-278273

Database identifiers

CAS
335428-90-5
PubChem CID
18629366

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
10
Formal charge
0
Complexity
106

Chemistry & industry

Suppliers2 total

珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]

Related reactions

8 records
New reaction record
HRID 212797 reaction equation
HRID 212797As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 945123 reaction equation
HRID 945123As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1061463 reaction equation
HRID 1061463As reactantuspto-grants-2003_02
HRID 1170907 reaction equation
HRID 1170907As reactantuspto-grants-2010_11
HRID 1407552 reaction equation
HRID 1407552As reactantuspto-grants-2014_12
HRID 1536849 reaction equation
HRID 1536849As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1965400 reaction equation
HRID 1965400As reactantuspto-grants-2013_04
HRID 2385132 reaction equation
HRID 2385132As reactantuspto-grants-2012_09

Compound notes

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