1611-57-0,MFCD00209615
Catalog No.:AA001S2Z

1611-57-0 | Pentane, 2-isocyanato-2,4,4-trimethyl-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
3 weeks  
$92.00   $64.00
- +
2.5g
95%
3 weeks  
$106.00   $74.00
- +
5g
95%
3 weeks  
$142.00   $99.00
- +
10g
95%
3 weeks  
$215.00   $150.00
- +
  • Technical Information
  • Properties
  • Literature
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Technical Information
Catalog Number:
AA001S2Z
Chemical Name:
Pentane, 2-isocyanato-2,4,4-trimethyl-
CAS Number:
1611-57-0
Molecular Formula:
C9H17NO
Molecular Weight:
155.2374
MDL Number:
MFCD00209615
SMILES:
O=C=NC(CC(C)(C)C)(C)C
NSC Number:
6402
Properties
Computed Properties
 
Complexity:
171  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.7  

Literature
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SDS
Tags:1611-57-0 Molecular Formula|1611-57-0 MDL|1611-57-0 SMILES|1611-57-0 Pentane, 2-isocyanato-2,4,4-trimethyl-
Catalog No.: AA001S2Z
1611-57-0,MFCD00209615
1611-57-0 | Pentane, 2-isocyanato-2,4,4-trimethyl-
Pack Size: 1g
Purity: 95%
3 weeks
$92.00 $64.00
Pack Size: 2.5g
Purity: 95%
3 weeks
$106.00 $74.00
Pack Size: 5g
Purity: 95%
3 weeks
$142.00 $99.00
Pack Size: 10g
Purity: 95%
3 weeks
$215.00 $150.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA001S2Z
Chemical Name: Pentane, 2-isocyanato-2,4,4-trimethyl-
CAS Number: 1611-57-0
Molecular Formula: C9H17NO
Molecular Weight: 155.2374
MDL Number: MFCD00209615
SMILES: O=C=NC(CC(C)(C)C)(C)C
NSC Number: 6402
Properties
Complexity: 171  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.7  
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