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34841-35-5,MFCD00009925
Catalog No.:AA003IPO
34841-35-5 | 3'-Chloropropiophenone
Pack Size
Purity
Availability
Price(USD)
Quantity
  
25g
98%
in stock  
$18.00   $12.00
- +
500g
98%
in stock  
$215.00   $150.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003IPO
Chemical Name:
3'-Chloropropiophenone
CAS Number:
34841-35-5
Molecular Formula:
C9H9ClO
Molecular Weight:
168.6202
MDL Number:
MFCD00009925
IUPAC Name:
1-(3-chlorophenyl)propan-1-one
InChI:
InChI=1S/C9H9ClO/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3
InChI Key:
PQWGFUFROKIJBO-UHFFFAOYSA-N
SMILES:
CCC(=O)c1cccc(c1)Cl
EC Number:
252-242-3
UNII:
2697RI8Z48
Properties
Computed Properties
 
Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.034g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.62g/mol
Monoisotopic Mass:
168.034g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

Synonyms
 
3'-Chloropropiophenone 
34841-35-5 
1-(3-Chloro-phenyl)-propan-1-one 
2697RI8Z48 
EINECS 252-242-3 
m-chloro-propiophenone 
PubChem3083 
3'-chloro-propiophenone 
ACMC-1AHE5 
EC 252-242-3 
AC1LBQ82 
AC1Q2RO1 
1-(3-chlorophenyl)propan-1-one 
DSSTox_CID_29133 
DSSTox_RID_83352 
DSSTox_GSID_49277 
SCHEMBL116338 
Jsp006300 
CHEMBL2251583 
DTXSID1049277 
CTK4H3110 
PQWGFUFROKIJBO-UHFFFAOYSA- 
1-(3-Chlorophenyl)-1-propanone 
m-Chloropropiophenone 
ZINC407109 
1-Propanone,1-(3-chlorophenyl)- 
KS-00000C4H 
Tox21_202823 
1-(3-Chlorophenyl)-1-propanone # 
ANW-27989 
BBL011448 
SBB058431 
STL146560 
AKOS000119340 
3-Chlorophenyl Ethyl Ketone 
LS41311 
MCULE-4018110321 
PS-6116 
RL03298 
TRA0073782 
NCGC00260369-01 
AC-10818 
AJ-22608 
AK101591 
BC226916 
UNII-2697RI8Z48 
CJ-04153 
SY018227 
ZB013810 
AB0011072 
CAS-34841-35-5 
TC-116734 
TL8002590 
A6116 
FT-0615522 
ST24021045 
1-Propanone, 1-(3-chlorophenyl)- 
ST50405393 
MFCD00009925 (98%) 
A-8325 
3 inverted exclamation mark -Chloropropiophenone 
A822431 
I01-2510 
W-106706 
F0001-1011 
Z1250100718 
InChI=1/C9H9ClO/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3 
MFCD00009925 
m-Chlorophenylacetone 
3-Chloropropiophenone 
3'-chloro propiophenone 
C9H9ClO 
3/'-Chloropropiophenone 
C9-H9-Cl-O 
(3-CHLOROPHENYL)PROPAN-1-ONE 
1-Chlor-3-(1-propanoyl)benzol 
CID587128 
ZINC00407109 
3'-Chloropropiophenone, 98% 
3'-Chloropropiophenone, 98% - 25G 25g 
C2033 
936-59-4 
PQWGFUFROKIJBO-UHFFFAOYSA-N 
Literature

Title: Vibrational spectroscopy investigation using ab initio and density functional theory on 3'-chloropropiophenone and 3'-nitropropiophenone.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20100201

Title: Global antifungal profile optimization of chlorophenyl derivatives against Botrytis cinerea and Colletotrichum gloeosporioides.

Journal: Journal of agricultural and food chemistry 20090610

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