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N-[2-(3,4-dihydroxyphenyl)ethyl]acetamide

N-[2-(3,4-dihydroxyphenyl)ethyl]acetamide

CAS: 2494-12-4

Formula: C10H13NO3

SMILES: CC(=O)NCCC1=CC=C(O)C(O)=C1

IUPAC: N-[2-(3,4-dihydroxyphenyl)ethyl]acetamide

InChI: InChI=1S/C10H13NO3/c1-7(12)11-5-4-8-2-3-9(13)10(14)6-8/h2-3,6,13-14H,4-5H2,1H3,(H,11,12)

Composition: C (61.53%), H (6.71%), N (7.18%), O (24.59%)

Molar Mass: 195.218

Atom Count: 27

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 195.089543283
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey OFSAJYZMIPNPHE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.69
Topological Polar Surface Area 69.56
Polarizability 20.13
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 2494-12-4 $78.18-$290.03$78.18$119.80$290.03
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