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2-Fluorobutanoic acid

HCID 9898
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
433-44-3
Standard SMILES
CCC(F)C(=O)O
InChIKey
GCSPSGQVZXMPKU-UHFFFAOYSA-N
Molecular formula
C4H7FO2
Average molar mass
106.1 g/mol
Monoisotopic mass
106.04300762

Names & identifiers

Preferred name
2-Fluorobutanoic acid
IUPAC
2-fluorobutanoic acid
English name
2-Fluorobutanoic acid
Molecular formula
C4H7FO2
Molecular weight
106.1

Names & synonyms

2-fluorobutanoic acid433-44-3DTXSID701314784RefChem:472625DTXCID401461611838-702-12-Fluorobutyric acidBUTYRIC ACID, 2-FLUORO-Butanoic acid, 2-fluoro-MFCD01737297alpha-Fluorobutanoic acidNSC 84353
Show more names
BRN 1745517AI3-28551fluorobutyric acid2-fluorobutanoicacidWLN: QVYF2SCHEMBL310632SCHEMBL6597286SCHEMBL8936500

Database identifiers

CAS
433-44-3
PubChem CID
9898
DTXSID
DTXSID701314784
EC Number
838-702-1
Nikkaji
J48.520I

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
7
Formal charge
0
Complexity
72.1

Physicochemical properties

Symbol(GHS)
5 · GHS05,GHS07
Signal word
Danger
Hazard statements
314 · H314-H335
Precautionary statements
260 · P260-P280-P305+P351+P338
HS Code
2915907098 · 2915907098

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

H227 (100%): Combustible liquid [Warning Flammable liquids]

P210, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 4 (100%)

Safety data

hs_code
2915907098
Signal word
Danger
Symbol(GHS)
GHS05,GHS07
Hazard statements
H314-H335
Precautionary statements
P260-P280-P305+P351+P338

Chemistry & industry

Suppliers5 total

常州协丰医药研发有限公司519-85601385 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
上海未原科技有限公司13024122785 17356341931 · [email protected]
常州优瑞医药科技有限公司18168818882 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]

Related reactions

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Compound notes

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