ethyl 3-(N-ethylacetamido)propanoate 52304-40-2 CAS NO.52304-40-2

Min.Order: 1 Gram
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Product Details

Keywords

b-Alanine, N-acetyl-N-ethyl-,ethyl ester
ethyl 3-(N-ethylacetamido)propanoate
52304-40-2

Quick Details

ProName: ethyl 3-(N-ethylacetamido)propanoate ...
CasNo: 52304-40-2
Molecular Formula: C9H17NO3
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

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Details

Identification and Related Records
【Name】
b-Alanine, N-acetyl-N-ethyl-,ethyl ester
【CAS Registry number】
52304-40-2
【Synonyms】
NSC144979
【Molecular Formula】
C9H17 N O3 (Products with the same molecular formula)
【Molecular Weight】
187.2362
【Inchi】
InChI=1/C9H17NO3/c1-4-10(8(3)11)7-6-9(12)13-5-2/h4-7H2,1-3H3
【Canonical SMILES】
CCN(CCC(=O)OCC)C(=O)C
Chemical and Physical Properties
【Density】
1.012g/cm3
【Boiling Point】
281.8°C at 760 mmHg
【Refractive Index】
1.445
【Flash Point】
124.2°C
【Computed Properties】
Molecular Weight:187.23618 [g/mol]
Molecular Formula:C9H17NO3
XLogP3-AA:0.3
H-Bond Donor:0
H-Bond Acceptor:3
Rotatable Bond Count:6
Exact Mass:187.120843
MonoIsotopic Mass:187.120843
Topological Polar Surface Area:46.6
Heavy Atom Count:13
Formal Charge:0
Complexity:180
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
Effective Rotor Count:7
Conformer Sampling RMSD:0.8
CID Conformer Count:149

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