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27613-36-1,MFCD12197728
Catalog No.:AA002U6F

27613-36-1 | 5-Formyl-2-methylbenzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$34.00   $24.00
- +
1g
97%
in stock  
$113.00   $80.00
- +
5g
97%
in stock  
$319.00   $224.00
- +
25g
97%
in stock  
$1,158.00   $811.00
- +
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Technical Information
Catalog Number:
AA002U6F
Chemical Name:
5-Formyl-2-methylbenzonitrile
CAS Number:
27613-36-1
Molecular Formula:
C9H7NO
Molecular Weight:
145.1580
MDL Number:
MFCD12197728
SMILES:
O=Cc1ccc(c(c1)C#N)C
Properties
Computed Properties
 
Complexity:
191  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
1.5  

Literature
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Additional Info:
SDS
Tags:27613-36-1 Molecular Formula|27613-36-1 MDL|27613-36-1 SMILES|27613-36-1 5-Formyl-2-methylbenzonitrile