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(RS)-Nifenalol

HCID 6317
NotesReactions
Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
7413-36-7
Standard SMILES
CC(C)NCC(O)c1ccc([N+](=O)[O-])cc1
InChIKey
UAORFCGRZIGNCI-UHFFFAOYSA-N
Molecular formula
C11H16N2O3
Average molar mass
224.26 g/mol
Monoisotopic mass
224.11609238

Overview

Nifenalol is a C-nitro compound.

Names & identifiers

Preferred name
(RS)-Nifenalol
IUPAC
1-(4-nitrophenyl)-2-(propan-2-ylamino)ethanol
English name
nifenalol
Molecular formula
C11H16N2O3
Molecular weight
224.26

Names & synonyms

Nifenalol7413-36-7racemic nifenalolNifenalolumDL-INPEADTXSID9048693D1DE63830PDTXCID5028619nifenalolo(RS)-Nifenalol1-(4-nitrophenyl)-2-isopropylaminoethanolRefChem:906440
Show more names
nifenalol.HCnifenalol HCLUnii-D1de63830pEinecs 231-023-6Nifenalolum [inn-latin](±)-α-[(Isopropylamino)methyl]-4-nitrobenzenemethanol
231-023-6isophenethanolNifenalol [INN]1-(4-nitrophenyl)-2-(propan-2-ylamino)ethanol1-(4-nitrophenyl)-2-[(propan-2-yl)amino]ethan-1-ol2-(isopropylamino)-1-(4-nitrophenyl)ethanol5054-57-9alpha-((Isopropylamino)methyl)-p-nitrobenzyl alcohol

Database identifiers

CAS
7413-36-7
PubChem CID
6317
DTXSID
DTXSID9048693
ChEMBL
CHEMBL127349、CHEMBL4753415
ChEBI
CHEBI:134921
UNII
D1DE63830P

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
78.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
220

Experimental & physicochemical properties

Human DrugsPharmaceuticals

Physicochemical properties

Melting point
98 ° · 98°
FDA UNII
1 DE63830P · D1DE63830P

Chemistry & industry

Uses & manufacturing

Use ClassificationPharmaceuticals
Applications · 1 item

UsesNifenalolis a beta adrenergic antagonist. In addition, compounds containing 2-amino-1-arylethanol are often α- orβ-adrenergic blocking agents that are useful for developing treatments for cardiovascular disease, cardiac failure, asthma and glaucoma.

Suppliers15 total

陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
广州致雅医药科技有限公司18122150900 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
滁州市科迈尔化工科技有限公司0550-5196001 15000891977 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]

Related reactions

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New reaction record

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
EC Number
231-023-6
Nikkaji
J41.849H
TargetMol中国(陶术生物)
4008200310 15002144251 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
淄博航宇生物科技发展有限公司+86-0533-2185556 +86-15965530500 · [email protected]
上海博拓生物科技有限公司16621358918 · [email protected]
Henan Fengda Chemical Co., Ltd+86-371-86557731 +86-13613820652 · [email protected]

Additional notes

DefinitionChEBI: Nifenalol is a C-nitro compound.