2-methoxyethyl hexanoate(CAS No. 5461-60-9) CAS NO.5461-60-9

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Keywords

2-methoxyethyl hexanoate
5461-60-9
98%

Quick Details

ProName: 2-methoxyethyl hexanoate(CAS No. 5461-...
CasNo: 5461-60-9
Molecular Formula: C9H18O3
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

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Details

【Name】
2-methoxyethyl hexanoate
【Iupac name】
2-methoxyethyl hexanoate
【CAS Registry number】
5461-60-9
【Synonyms】
2-methoxyethyl hexanoate
5461-60-9
NSC6550
AC1L5AJY
AC1Q688X
NSC-6550
AR-1E3201
【Molecular Formula】
C9H18O3 (Products with the same molecular formula)
【Molecular Weight】
174.2374
【Inchi】
InChI=1/C9H18O3/c1-3-4-5-6-9(10)12-8-7-11-2/h3-8H2,1-2H3
【Canonical SMILES】
CCCCCC(=O)OCCOC
【MOL File】
5461-60-9.mol
Chemical and Physical Properties
【Density】
0.932g/cm3
【Boiling Point】
225.9°C at 760 mmHg
【Refractive Index】
1.419
【Flash Point】
75.7°C
【Computed Properties】
Molecular Weight:174.23742 [g/mol]
Molecular Formula:C9H18O3
XLogP3-AA:1.9
H-Bond Donor:0
H-Bond Acceptor:3
Rotatable Bond Count:8
Exact Mass:174.125594
MonoIsotopic Mass:174.125594
Topological Polar Surface Area:35.5
Heavy Atom Count:12
Formal Charge:0
Complexity:112
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
Feature 3D Acceptor Count:2
Feature 3D Hydrophobe Count:2
Effective Rotor Count:8
Conformer Sampling RMSD:0.8
CID Conformer Count:332

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