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Basic information
- CAS
86-22-6- Standard SMILES
CN(C)CCC(c1ccc(Br)cc1)c1ccccn1- InChIKey
ZDIGNSYAACHWNL-UHFFFAOYSA-N- Molecular formula
- C16H19BrN2
- Average molar mass
- 319.24 g/mol
- Monoisotopic mass
- 318.07316
Names & identifiers
- Preferred name
- Brompheniramine
- IUPAC
- 3-(4-bromophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine
- English name
- Brompheniramine
- Molecular formula
- C16H19BrN2
- Molecular weight
- 319.24
Names & synonyms
BROMPHENIRAMINE86-22-6ParabromdylamineBromfeniraminaBrompheniraminumBromfedBromfenexBrotane3-(4-bromophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine1-(p-Bromophenyl)-1-(2-pyridyl)-3-dimethylaminopropane3-(p-Bromophenyl)-3-(2-pyridyl)-N,N-dimethylpropylamine2-(p-Bromo-alpha-(2-dimethylaminoethyl)benzyl)pyridine
Show more names
IlvinbromopheniramineParabromodylamine2-BromopheniramineBROMPHENIRAMINE BASEBrompheniramine USP/EP/BPBROMPHENIRAMINE(BROMPHENIRAMINE)3-(4-bromophenyl)-3-(2-pyridyl)propyldimethylamine
Dimetapp Allergy3-(4-Bromophenyl)-N,N-dimethyl-3-(2-pyridinyl)-1-propanamineH57G17P2FNgamma-(4-Bromophenyl)-N,N-dimethyl-2-pyridinepropanamineCHEBI:31832-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-DTXSID5022691Pyridine, 2-(p-bromo-alpha-(2-(dimethylamino)ethyl)benzyl)-
Database identifiers
- CAS
86-22-6- PubChem CID
- 6834
- DTXSID
DTXSID5022691- ChEMBL
CHEMBL811- ChEBI
CHEBI:3183- UNII
- H57G17P2FN
- EC Number
- 201-657-8
- Nikkaji
- J4.936K
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 16.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 249
Physicochemical properties
- Melting point
- 25 °C · 25°C
- Boiling point
- 0.5 · bp0.5 147-152°
- Density
- 1.374 · 1.3740 (rough estimate)
- refractive index
- 1.577 · 1.5770 (estimate)
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Oil
- pka
- 3.59 · pKa 3.59 (Uncertain)
- color
- Colourless
- InChI
- InChI=1S/C16H19BrN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3
- InChIKey
- ZDIGNSYAACHWNL-UHFFFAOYSA-N
- SMILES
- C1(C(C2=CC=C(Br)C=C2)CCN(C)C)=NC=CC=C1
- CAS DataBase Reference
- 86 · 86-22-6(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 57 G17P2FN · H57G17P2FN
- ATC code
- 6 AB01,R06AB51 · R06AB01,R06AB51
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
- tsca
- TSCA listed
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS07
- Hazard statements
- H301-H315-H319-H335
- REACH Registrations
- Active
- Precautionary statements
- P261-P280-P305+P351+P338-P304+P340-P405-P501
- Hazardous Substances Data
- 86-22-6(Hazardous Substances Data)
Chemistry & industry
Applications
Usesantidepressant
UsesBrompheniramine is also used for allergy symptoms, rhinitis, and dermatitis. Its activity is approximately the same as that of chlorpheniramine. Synonyms of this drug are dimetane, brombey, spentan, veltane, and others.
Suppliers32 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海合必成医药科技有限公司19564164886 13701791899 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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