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19594-40-2,MFCD00027319
Catalog No.:AA003HKP
19594-40-2 | 2-METHYL-4-UNDECANONE
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Purity
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Price(USD)
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1g
95%
in stock  
$496.00
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25g
95%
in stock  
$2,130.00
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  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HKP
Chemical Name:
2-METHYL-4-UNDECANONE
CAS Number:
19594-40-2
Molecular Formula:
C12H24O
Molecular Weight:
184.3184
MDL Number:
MFCD00027319
IUPAC Name:
2-methylundecan-4-one
InChI:
InChI=1S/C12H24O/c1-4-5-6-7-8-9-12(13)10-11(2)3/h11H,4-10H2,1-3H3
InChI Key:
IEBAJFDSHJYDCK-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)CC(C)C
EC Number:
243-176-6
UNII:
LN53YFA9O0
NSC Number:
60572
Properties
Computed Properties
 
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.183g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.323g/mol
Monoisotopic Mass:
184.183g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  

Synonyms
 
2-Methyl-4-undecanone 
19594-40-2 
NSC 60572 
ACMC-209ezu 
n-Heptyl isobutyl ketone 
AC1Q2VVA 
AC1L6J5Q 
AC1Q5H8J 
SCHEMBL608057 
DTXSID3066508 
CTK0H6636 
IEBAJFDSHJYDCK-UHFFFAOYSA-N 
2-Methylundecan-4-one 
NSC60572 
ZINC1690313 
ANW-23704 
MFCD00027319 
NSC-60572 
AKOS009158801 
CS-W004342 
MCULE-8560500059 
ACM19594402 
CC-11405 
4-Undecanone, 2-methyl- 
SC-99489 
SY053651 
DB-044924 
TX-016497 
FT-0637881 
I0250 
MFCD00027319 (97%) 
C-07271 
Isobutyl heptyl ketone 
C12H24O 
Heptyl isobutyl ketone 
AR-1E4221 
C12-H24-O 
CID246924 
2243-44-9 
UNII-LN53YFA9O0 
LN53YFA9O0 
isobutylheptylketon 
EINECS 243-176-6 
methyl-4-undecanone 
Literature
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