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3-Bromo-4-(trifluoromethyl)benzenemethanamine

HCID 22337652
NotesReactions

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

Basic information

CAS
581813-19-6
Standard SMILES
NCc1ccc(C(F)(F)F)c(Br)c1
InChIKey
PVIZLIZHGMUBAZ-UHFFFAOYSA-N
Molecular formula
C8H7BrF3N
Average molar mass
254.049 g/mol
Monoisotopic mass
252.97139598

Names & identifiers

Preferred name
3-Bromo-4-(trifluoromethyl)benzenemethanamine
IUPAC
1-[3-Bromo-4-(trifluoromethyl)phenyl]methanamine
English name
(3-broMo-4-(trifluoroMethyl)phenyl)MethanaMine
Molecular formula
C8H7BrF3N
Molecular weight
254.05

Names & synonyms

3-bromo-4-(trifluoromethyl)benzylamine3-Bromo-4-(trifluoromethyl)benzenemethanamine(3-broMo-4-(trifluoroMethyl)phenyl)MethanaMineBenzenemethanamine, 3-bromo-4-(trifluoromethyl)-1-[3-Bromo-4-(trifluoromethyl)phenyl]methanamine(3-Bromo-4-(trifluoromethyl)phenyl)methanamine - [B89364]

Database identifiers

CAS
581813-19-6
PubChem CID
22337652
DTXSID
DTXSID101254043

Properties

Physicochemical properties

Boiling point
250.6 · 250.6±35.0 °C(Predicted)
Density
1.596 · 1.596±0.06 g/cm3(Predicted)
storage temp.
2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka
8.31 · 8.31±0.10(Predicted)
Appearance
Light yellow to yellow Liquid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
HS Code
2921490090 · 2921490090

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

hs_code
2921490090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Suppliers20 total

温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
江苏药恒医药科技有限公司13524761129 · [email protected]
Aceschem Inc.+1-817863-6948 +1-(817)863-6948 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
西安峥鎏生物科技有限公司15594552852 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
Changzhou Ansciep Chemical Co., Ltd.+86 519 86305871 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [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]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
山东煜昌药业有限公司531-87153728 13805401165 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

4 records
New reaction record
HRID 586020 reaction equation
HRID 586020As productuspto-grants-2005_08
HRID 887288 reaction equation
HRID 887288As productuspto-grants-2012_08
HRID 2056907 reaction equation
HRID 2056907As productuspto-grants-2008_02
HRID 2152029 reaction equation
HRID 2152029As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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