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2-Amino-2-(3,4-difluorophenyl)ethanol

HCID 22048878
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
218449-32-2
Standard SMILES
NC(CO)c1ccc(F)c(F)c1
InChIKey
ONJNHFPGJRBNQM-UHFFFAOYSA-N
Molecular formula
C8H9F2NO
Average molar mass
173.16 g/mol
Monoisotopic mass
173.06522023

Names & identifiers

Preferred name
2-Amino-2-(3,4-difluorophenyl)ethanol
IUPAC
2-amino-2-(3,4-difluorophenyl)ethanol
English name
2-aMino-2-(3,4-difluorophenyl)ethanol hydrochloride
Molecular formula
C8H9F2NO
Molecular weight
173.16

Names & synonyms

2-amino-2-(3,4-difluorophenyl)ethanol218449-32-22-Amino-2-(3,4-difluorophenyl)ethan-1-ol2-(3,4-Difluorophenyl)-2-aminoethanolMFCD11213677SCHEMBL4072121ONJNHFPGJRBNQM-UHFFFAOYSA-NDTXSID201296246AKOS005266023BS-9729SB45161SB45475
Show more names
Benzeneethanol, β-amino-3,4-difluoro-2-aMino-2-(3,4-difluorophenyl)ethanol hydrochloride
I(2)-Amino-3,4-difluorobenzeneethanol2-amino-2-(3,4-difluorophenyl)-ethanolDB-346668CS-0433513(+)-2-amino-2-(3,4-difluorophenyl)-ethanolN11182EN300-1260954F514353

Database identifiers

CAS
218449-32-2
PubChem CID
22048878
DTXSID
DTXSID201296246

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
46.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
145

Physicochemical properties

storage temp.
2 · 2-8°C, protect from light
Appearance
Off-white to yellow Solid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers15 total

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
北京依凯诺医药技术开发有限公司18518619637 · [email protected]
郑州药领医药科技有限公司13526569071 · [email protected]
天津林宸科技有限公司15122256084 15122256084 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
上海策嵘生物科技有限公司(定制合成实验室)13062833949 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
西安峥鎏生物科技有限公司15594552852 · [email protected]
河北博新生物科技有限公司19131160546 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
佰美济华(河南)医药科技有限公司0371-88900765 18037465274 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]

Related reactions

17 records
New reaction record
HRID 164561 reaction equation
HRID 164561As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 278897 reaction equation
HRID 278897As reactantuspto-grants-2002_03
HRID 278899 reaction equation
HRID 278899As reactantuspto-grants-2002_03
HRID 278902 reaction equation
HRID 278902As productuspto-grants-2002_03
HRID 324307 reaction equation
HRID 324307As reactantuspto-grants-2001_04
HRID 324309 reaction equation
HRID 324309As reactantuspto-grants-2001_04
HRID 324312 reaction equation
HRID 324312As productuspto-grants-2001_04
HRID 694112 reaction equation
HRID 694112As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
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Compound notes

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