- Product Details
Keywords
- Propanamide,2,2'-oxybis-
- 5460-66-2
- 98%
Quick Details
- ProName: Propanamide,2,2'-oxybis-(CAS No. 5460-...
- CasNo: 5460-66-2
- Molecular Formula: C6H12 N2 O3
- Appearance: Solid
- Application: Organic Chemicals
- DeliveryTime: according to client's demand quantity
- PackAge: as requested
- Port: SHANGHAI
- ProductionCapacity: 1 Metric Ton/Month
- Purity: 99%
- Storage: room temperature
- Transportation: as requested
- LimitNum: 1 Gram
Superiority
Details
【Name】
Propanamide,2,2'-oxybis-
【CAS Registry number】
5460-66-2
【Synonyms】
NSC 18703
【Molecular Formula】
C6H12 N2 O3 (Products with the same molecular formula)
【Molecular Weight】
500.5457
【Inchi】
InChI=1/C28H28N4O5/c1-5-16(2)17-10-12-18(13-11-17)22-14-20(19-8-6-7-9-21(19)30-22)27(35)37-15-23(33)24-25(29)31(3)28(36)32(4)26(24)34/h6-14,16H,5,15,29H2,1-4H3
【Canonical SMILES】
CC(C(=O)N)OC(C)C(=O)N
Chemical and Physical Properties
【Density】
1.279g/cm3
【Boiling Point】
671.8°C at 760 mmHg
【Refractive Index】
1.625
【Flash Point】
360.1°C
【Computed Properties】
Molecular Weight:160.17108 [g/mol]
Molecular Formula:C6H12N2O3
XLogP3-AA:-1.2
H-Bond Donor:2
H-Bond Acceptor:3
Rotatable Bond Count:4
Tautomer Count:6
Exact Mass:160.084792
MonoIsotopic Mass:160.084792
Topological Polar Surface Area:95.4
Heavy Atom Count:11
Formal Charge:0
Complexity:151
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:3
Feature 3D Donor Count:2
Effective Rotor Count:4
Conformer Sampling RMSD:0.6
CID Conformer Count:130