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Bis(2,6-Diisopropylphenyl)Carbodiimide
CAS: 2162-74-5 | C25H34N2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2162-74-5
Molecular Formula:
C25H34N2
Molecular Mass:
362.56 g/mol
Names and Synonyms:
Bis(2,6-Diisopropylphenyl)Carbodiimide
Benzenamine, N,N′-methanetetraylbis[2,6-bis(1-methylethyl)-
Carbodiimide, bis(2,6-diisopropylphenyl)-
N,N′-Methanetetraylbis[2,6-bis(1-methylethyl)benzenamine]
N,N′-Bis(2,6-diisopropylphenyl)carbodiimide
Bis(o,o′-diisopropylphenyl)carbodiimide
Bis(2,6-diisopropylphenyl)carbodiimide
Carbo D
Stabaxol 1
Stabaxol I
N,N′-(2,2′,6,6′-Tetraisopropyldiphenyl)carbodiimide
Raschig 7000
N,N′-Di-2,6-diisopropylphenylcarbodiimide
Stabilizer 7000
Stabilizer 7000F
Additin RC 8500
Stabaxol P 1
EN 160
Stabaxol I-LF
Stabaxol EN 160
DIPC
2,2′,6,6′-Tetraisopropyldiphenylcarbodiimide
Hycasyl 1001
R 7000
S 7000
SY 7000
Zika AH 362
Stabaxol I-CF
Staboxol I
Chinox SA 1
SA 1
Identifiers:
SMILES:
CC(C)c1cccc(C(C)C)c1N=C=Nc1c(C(C)C)cccc1C(C)C
InChI:
InChI=1S/C25H34N2/c1-16(2)20-11-9-12-21(17(3)4)24(20)26-15-27-25-22(18(5)6)13-10-14-23(25)19(7)8/h9-14,16-19H,1-8H3
Key Properties
Boiling Point
152-162 °C @ Press: 0.05 Torr
CAS Common Chemistry
Melting Point
47-49.5 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 362.56 g/mol | CAS Common Chemistry |
| 362.56100000000004 g/mol | RDKit | |
| 362.272199088 g/mol | RDKit | |
| Boiling Point | 152-162 °C @ Press: 0.05 Torr | CAS Common Chemistry |
| Canonical SMILES | C(=NC=1C(=CC=CC1C(C)C)C(C)C)=NC=2C(=CC=CC2C(C)C)C(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C25H34N2/c1-16(2)20-11-9-12-21(17(3)4)24(20)26-15-27-25-22(18(5)6)13-10-14-23(25)19(7)8/h9-14,16-19H,1-8H3 | CAS Common Chemistry |
| InChI Key | InChIKey=XLDBGFGREOMWSL-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 47-49.5 °C | CAS Common Chemistry |
| Name | Bis(2,6-diisopropylphenyl)carbodiimide | CAS Common Chemistry |
| Heavy Atom Count | 27 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 6 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 24.72 Ų | RDKit |
| LogP | 8.317300000000005 | RDKit |
| Molar Refractivity | 118.42300000000004 | RDKit |
