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696-29-7,MFCD00001480
Catalog No.:AA003R2H

696-29-7 | Isopropylcyclohexane

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$27.00   $19.00
- +
5g
98%
in stock  
$35.00   $25.00
- +
25g
98%
in stock  
$75.00   $53.00
- +
100g
98%
in stock  
$202.00 $142.00
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003R2H
Chemical Name:
Isopropylcyclohexane
CAS Number:
696-29-7
Molecular Formula:
C9H18
Molecular Weight:
126.2392
MDL Number:
MFCD00001480
SMILES:
CC(C1CCCCC1)C
NSC Number:
73963
UN Number:
3295
Properties
Properties
 
BP:
154.8°C  
Form:
Liquid  

Computed Properties
 
Complexity:
68.1  
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:
0  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.3  

Literature

Title: Molecular dynamics simulations of structure and dynamics of organic molecular crystals.

Journal: Physical chemistry chemical physics : PCCP 20101207

Title: Rate constants of nine C6-C9 alkanes with OH from 230 to 379 K: chemical tracers for [OH].

Journal: The journal of physical chemistry. A 20090430

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SDS
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Tags:696-29-7 Molecular Formula|696-29-7 MDL|696-29-7 SMILES|696-29-7 Isopropylcyclohexane
Catalog No.: AA003R2H
696-29-7,MFCD00001480
696-29-7 | Isopropylcyclohexane
Pack Size： 1g
Purity： 98%
in stock
$27.00 $19.00
Pack Size： 5g
Purity： 98%
in stock
$35.00 $25.00
Pack Size： 25g
Purity： 98%
in stock
$75.00 $53.00
Pack Size： 100g
Purity： 98%
in stock
$202.00 $142.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003R2H
Chemical Name: Isopropylcyclohexane
CAS Number: 696-29-7
Molecular Formula: C9H18
Molecular Weight: 126.2392
MDL Number: MFCD00001480
SMILES: CC(C1CCCCC1)C
NSC Number: 73963
UN Number: 3295
Properties
BP: 154.8°C  
Form: Liquid  
Complexity: 68.1  
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: 0  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.3  
Literature fold

Title: Molecular dynamics simulations of structure and dynamics of organic molecular crystals.

Journal: Physical chemistry chemical physics : PCCP20101207

Title: Rate constants of nine C6-C9 alkanes with OH from 230 to 379 K: chemical tracers for [OH].

Journal: The journal of physical chemistry. A20090430

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