Basic information
- CAS
65086-89-7- Standard SMILES
O=C(Nc1ccc(Cc2ccc(NC(=O)Oc3ccccc3)cc2)cc1)Nc1ccc(Cc2ccc(NC(=O)Oc3ccccc3)cc2)cc1- InChIKey
BYBZVHGGXGVFIZ-UHFFFAOYSA-N- Molecular formula
- C41H34N4O5
- Average molar mass
- 662.7 g/mol
- Monoisotopic mass
- 662.2529202
Names & identifiers
- Preferred name
- Carbamic acid, N,N'-(carbonylbis(imino-4,1-phenylenemethylene-4,1-phenylene))bis-, C,C'-diphenyl ester
- IUPAC
- phenyl N-[4-[[4-[[4-[[4-(phenoxycarbonylamino)phenyl]methyl]phenyl]carbamoylamino]phenyl]methyl]phenyl]carbamate
- English name
- diphenyl [carbonylbis(imino-4,1-phenylenemethylene-4,1-phenylene)]biscarbamate
- Molecular formula
- C41H34N4O5
- Molecular weight
- 662.73
Names & synonyms
EINECS 265-385-1Carbanilic acid, 4,4'-(ureylenebis(p-phenylenemethylene))di-, diphenyl esterCarbamic acid, (carbonylbis(imino-4,1-phenylenemethylene-4,1-phenylene))bis-, diphenyl esterCarbamic acid, N,N'-(carbonylbis(imino-4,1-phenylenemethylene-4,1-phenylene))bis-, C,C'-diphenyl esterCarbamic acid, N,N'-[carbonylbis(imino-4,1-phenylenemethylene-4,1-phenylene)]bis-, C,C'-diphenyl esterRefChem:57393565086-89-7Diphenyl [carbonylbis(imino-4,1-phenylenemethylene-4,1-phenylene)]biscarbamateDiphenyl (carbonylbis(imino-4,1-phenylenemethylene-4,1-phenylene))biscarbamateDTXSID90983636BYBZVHGGXGVFIZ-UHFFFAOYSA-NNS00055191
Show more names
1,3-Bis[4-[4-(phenoxycarbonylamino)benzyl]phenyl]urea[Carbonylbis(imino-4,1-phenylenemethylene-4,1-phenylene)]bis(carbamic acid phenyl) ester
Diphenyl [carbonylbis(azanediyl-4,1-phenylenemethylene-4,1-phenylene)]biscarbamate
Properties
Computed structural properties
- XLogP
- 8.6
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 50
- Formal charge
- 0
- Complexity
- 950
Physicochemical properties
- Boiling point
- 727.47 · 727.470±60.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.329 · 1.329±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 12.63 · 12.630±0.70(predicted)
- EPA Substance Registry System
- Diphenyl [carbonylbis(imino-4,1-phenylenemethylene-4,1-phenylene)]biscarbamate (65086-89-7)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCarbamic acid, N,N'-[carbonylbis(imino-4,1-phenylenemethylene-4,1-phenylene)]bis-, C,C'-diphenyl ester: INACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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