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Also known as: Schembl508496, N-benzyl-n-cyclohexylcarbodiimide, J3.541.507f, N-benzyl-n'-cyclohexylcarbodiimide, polymer-bound 100-300 mesh, extent of labeling: ~1.3 mmol/g n lo ~1.3 mmol/g n loading, N-benzyl-n'-cyclohexylcarbodiimide, polymer-bound, 100-200 mesh, extent of labeling: 1.0-2.0 mmol/g loading, 1 % cross-linked with divinylbenzene, N-benzyl-n'-cyclohexylcarbodiimide, polymer-bound, 100-300 mesh, extent of labeling: ~1.3 mmol/g n loading
Molecular Formula
C14H18N2
Molecular Weight
214.31  g/mol
InChI Key
PPJWMNPSKPESFN-UHFFFAOYSA-N

N,N-Dicyclohexylcarbodiimide
1 2D Structure

N,N-Dicyclohexylcarbodiimide

2 Identification
2.1 Computed Descriptors
2.1.1 InChI
InChI=1S/C14H18N2/c1-3-7-13(8-4-1)11-15-12-16-14-9-5-2-6-10-14/h1,3-4,7-8,14H,2,5-6,9-11H2
2.1.2 InChI Key
PPJWMNPSKPESFN-UHFFFAOYSA-N
2.1.3 Canonical SMILES
C1CCC(CC1)N=C=NCC2=CC=CC=C2
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. Schembl508496

2. N-benzyl-n-cyclohexylcarbodiimide

3. J3.541.507f

4. N-benzyl-n'-cyclohexylcarbodiimide, Polymer-bound 100-300 Mesh, Extent Of Labeling: ~1.3 Mmol/g N Lo ~1.3 Mmol/g N Loading

5. N-benzyl-n'-cyclohexylcarbodiimide, Polymer-bound, 100-200 Mesh, Extent Of Labeling: 1.0-2.0 Mmol/g Loading, 1 % Cross-linked With Divinylbenzene

6. N-benzyl-n'-cyclohexylcarbodiimide, Polymer-bound, 100-300 Mesh, Extent Of Labeling: ~1.3 Mmol/g N Loading

2.3 Create Date
2005-09-18
3 Chemical and Physical Properties
Molecular Weight 214.31 g/mol
Molecular Formula C14H18N2
XLogP34.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass214.146998583 g/mol
Monoisotopic Mass214.146998583 g/mol
Topological Polar Surface Area24.7 Ų
Heavy Atom Count16
Formal Charge0
Complexity242
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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04-Oct-2021
25-Oct-2024
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