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4-Bromo-N-(2-hydroxyethyl)benzamide

HCID 316802
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
57728-67-3
Standard SMILES
O=C(NCCO)c1ccc(Br)cc1
InChIKey
PUTNMGZYPWHWLJ-UHFFFAOYSA-N
Molecular formula
C9H10BrNO2
Average molar mass
244.08 g/mol
Monoisotopic mass
242.98949

Names & identifiers

Preferred name
4-Bromo-N-(2-hydroxyethyl)benzamide
IUPAC
4-bromo-N-(2-hydroxyethyl)benzamide
English name
4-BROMO-N-(2-HYDROXYETHYL)BENZENECARBOXAMIDE
Molecular formula
C9H10BrNO2
Molecular weight
244.09

Names & synonyms

4-bromo-N-(2-hydroxyethyl)benzamide57728-67-3DTXSID70311771RefChem:1070418DTXCID702628954-bromo-N-(2-hydroxyethyl)benzenecarboxamideMFCD00456170N-(2-Hydroxyethyl)-4-bromobenzamideNSC245186SCHEMBL16651832-(4-Bromobenzoylamino)ethanolPUTNMGZYPWHWLJ-UHFFFAOYSA-N
Show more names
Benzamide, 4-bromo-N-(2-hydroxyethyl)-
SBB099792AKOS0050708576M-559SNSC 245186NSC-2451864-Bromo-N-(2-hydroxy-ethyl)-benzamideDA-16650CS-0453745

Database identifiers

CAS
57728-67-3
PubChem CID
316802
DTXSID
DTXSID70311771
Nikkaji
J1.298.386G

Properties

Computed structural propertiesFilling in

XLogP
0.8
Topological polar surface area
49.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
13
Formal charge
0
Complexity
167

Physicochemical properties

Melting point
146 · 146-147°
storage temp.
2 · 2-8°C
Symbol(GHS)
2 · GHS02
Signal word
Danger
Hazard statements
225 · H225
Precautionary statements
210 · P210-P273-P243-P403
HazardClass
IRRITANT
HS Code
2924297099 · 2924297099

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
2924297099
Signal word
Danger
Symbol(GHS)
GHS02
hazard_class
IRRITANT
Hazard statements
H225
Precautionary statements
P210-P273-P243-P403

Related reactions

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