Acetic acid,2-thiocyanato-, tetradecyl ester 5399-27-9 CAS NO.5399-27-9

Min.Order: 1 Gram
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Product Details

Keywords

Acetic acid,2-thiocyanato-, tetradecyl ester
5399-27-9
C17H31 N O2 S

Quick Details

ProName: Acetic acid,2-thiocyanato-, tetradecyl...
CasNo: 5399-27-9
Molecular Formula: C17H31 N O2 S
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: according to client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 100 Kilogram/Month
Purity: 99%
Storage: room temperature
Transportation: as requested
LimitNum: 1 Gram
Heavy metal: N/A
Grade: Industrial Grade

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Details

【Name】
Acetic acid,2-thiocyanato-, tetradecyl ester
【CAS Registry number】
5399-27-9
【Synonyms】
Aceticacid, thiocyanato-, tetradecyl ester (9CI)
NSC 1329
【Molecular Formula】
C17H31 N O2 S (Products with the same molecular formula)
【Molecular Weight】
313.4985
【Inchi】
InChI=1/C17H31NO2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-17(19)15-21-16-18/h2-15H2,1H3
【Canonical SMILES】
CCCCCCCCCCCCCCOC(=O)CSC#N
Chemical and Physical Properties
【Density】
0.979g/cm3
【Boiling Point】
413.3°Cat760mmHg
【Refractive Index】
1.477
【Flash Point】
203.8°C
【Computed Properties】
Molecular Weight:313.49854 [g/mol]
Molecular Formula:C17H31NO2S
XLogP3-AA:7.5
H-Bond Donor:0
H-Bond Acceptor:4
Rotatable Bond Count:16
Exact Mass:313.20755
MonoIsotopic Mass:313.20755
Topological Polar Surface Area:75.4
Heavy Atom Count:21
Formal Charge:0
Complexity:286
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:1

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