- Product Details
Keywords
- Myritol 318
- Decanoyl- and octanoyl glycerides
- 52622-27-2
Quick Details
- ProName: Decanoyl- and octanoyl glycerides 526...
- CasNo: 52622-27-2
- Molecular Formula: C26H21BrN4O
- Appearance: Liquid
- Application: Organic Chemicals
- DeliveryTime: as client's demand quantity
- PackAge: as requested
- Port: SHANGHAI
- ProductionCapacity: 10 Kilogram/Month
- Purity: 99%
- Storage: room temperature
- Transportation: as requested
- LimitNum: 1 Gram
- Heavy metal: N/A
- Grade: Industrial Grade
Superiority
Details
Identification and Related Records
【Name】
Decanoyl- and octanoyl glycerides
【CAS Registry number】
52622-27-2
【Synonyms】
NEOBEE(R) M-5
NEOBEE(TM) M-5
TRIGLYCERIDE OF COCONUT OIL
captex300
miglyol810neutraloil
miglyol812neutraloil
myritol318
neobeem-5
【EINECS(EC#)】
277-452-2
【Molecular Formula】
C26H21BrN4O (Products with the same molecular formula)
【Molecular Weight】
0
【Inchi】
InChI=1S/C26H20N4O.BrH/c31-26(22-9-5-15-30(18-22)17-19-6-2-1-3-7-19)28-16-23-13-12-21-11-10-20-8-4-14-27-24(20)25(21)29-23;/h1-15,18H,16-17H2;1H
【Canonical SMILES】
C1=CC=C(C=C1)C[N+]2=CC=CC(=C2)C(=O)NCC3=NC4=C(C=CC5=C4N=CC=C5)C=C3.[Br-]
Chemical and Physical Properties
【Density】
0.94-0.96
【Computed Properties】
Molecular Weight:485.37514 [g/mol]
Molecular Formula:C26H21BrN4O
H-Bond Donor:1
H-Bond Acceptor:4
Rotatable Bond Count:5
Tautomer Count:2
Exact Mass:484.089874
MonoIsotopic Mass:484.089874
Topological Polar Surface Area:58.8
Heavy Atom Count:32
Formal Charge:0
Complexity:592
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:2