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1-Bromo-3-(4-chlorophenyl)propan-2-one

HCID 14748855
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Basic information

CAS
103557-35-3
Standard SMILES
O=C(CBr)Cc1ccc(Cl)cc1
InChIKey
GLUIQHUZOIOCAA-UHFFFAOYSA-N
Molecular formula
C9H8BrClO
Average molar mass
247.51 g/mol
Monoisotopic mass
245.94471

Names & identifiers

Preferred name
1-Bromo-3-(4-chlorophenyl)propan-2-one
IUPAC
1-bromo-3-(4-chlorophenyl)propan-2-one
English name
1-bromo-3-(4-chlorophenyl)propan-2-one
Molecular formula
C9H8BrClO
Molecular weight
247.52

Names & synonyms

1-BROMO-3-(4-CHLOROPHENYL)PROPAN-2-ONE103557-35-3RefChem:430383853-090-6MFCD11847556SCHEMBL622333GLUIQHUZOIOCAA-UHFFFAOYSA-NDEA55735AKOS017561576AB92148DB-3634131-bromo-3-(4-chloro-phenyl)-propan-2-one
Show more names
1-bromo-3-(4-chlorophenyl)acetone2-Propanone, 1-bromo-3-(4-chlorophenyl)-
CS-0440119EN300-258427A1-10624

Database identifiers

CAS
103557-35-3
PubChem CID
14748855
EC Number
853-090-6

Properties

Computed structural propertiesFilling in

XLogP
3
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
153

Physicochemical properties

storage temp.
Store at Room Tem.
Symbol(GHS)
7 · GHS07,GHS05
Signal word
Danger
Hazard statements
318 · H318-H302-H335-H315
Precautionary statements
280 · P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362

Safety & regulation

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

GHS classification

GHS Classification · 5 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%);Skin Irrit. 2 (100%);Eye Dam. 1 (100%);STOT SE 3 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS07,GHS05
Hazard statements
H318-H302-H335-H315
Precautionary statements
P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362

Related reactions

6 records
New reaction record
HRID 1644629 reaction equation
HRID 1644629As reactantuspto-grants-2012_02
HRID 1644662 reaction equation
HRID 1644662As reactantuspto-grants-2012_02
HRID 2401782 reaction equation
HRID 2401782As productuspto-grants-2014_08
HRID 2401783 reaction equation
HRID 2401783As reactantuspto-grants-2014_08
HRID 2402043 reaction equation
HRID 2402043As productuspto-grants-2014_08
HRID 2402044 reaction equation
HRID 2402044As reactantuspto-grants-2014_08

Compound notes

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