1885-81-0,MFCD05664317
Catalog No.:AA002GUO

1885-81-0 | 1-Chloro-4-isocyanobenzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$456.00   $319.00
- +
1g
98%
in stock  
$1,345.00 $942.00
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA002GUO
Chemical Name:
1-Chloro-4-isocyanobenzene
CAS Number:
1885-81-0
Molecular Formula:
C7H4ClN
Molecular Weight:
137.5664
MDL Number:
MFCD05664317
SMILES:
Clc1ccc(cc1)[N+]#[C-]
Properties
Computed Properties
 
Complexity:
127  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

Literature

Title: Donor-acceptor properties of isonitriles studied by photoelectron spectroscopy and electron transmission spectroscopy.

Journal: Journal of mass spectrometry : JMS 20041201

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Tags:1885-81-0 Molecular Formula|1885-81-0 MDL|1885-81-0 SMILES|1885-81-0 1-Chloro-4-isocyanobenzene
Catalog No.: AA002GUO
1885-81-0,MFCD05664317
1885-81-0 | 1-Chloro-4-isocyanobenzene
Pack Size: 250mg
Purity: 98%
in stock
$456.00 $319.00
Pack Size: 1g
Purity: 98%
in stock
$1,345.00 $942.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA002GUO
Chemical Name: 1-Chloro-4-isocyanobenzene
CAS Number: 1885-81-0
Molecular Formula: C7H4ClN
Molecular Weight: 137.5664
MDL Number: MFCD05664317
SMILES: Clc1ccc(cc1)[N+]#[C-]
Properties
Complexity: 127  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 9  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
Literature fold

Title: Donor-acceptor properties of isonitriles studied by photoelectron spectroscopy and electron transmission spectroscopy.

Journal: Journal of mass spectrometry : JMS20041201

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