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2-[(2-hydroxyethyl)amino]benzoic acid

2-[(2-hydroxyethyl)amino]benzoic acid

Formula: C9H11NO3

SMILES: OCCNC1=CC=CC=C1C(O)=O

IUPAC: 2-[(2-hydroxyethyl)amino]benzoic acid

InChI: InChI=1S/C9H11NO3/c11-6-5-10-8-4-2-1-3-7(8)9(12)13/h1-4,10-11H,5-6H2,(H,12,13)

Composition: C (59.66%), H (6.12%), N (7.73%), O (26.49%)

Molar Mass: 181.191

Atom Count: 24

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 181.073893218
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey KULNOANNPOGHQK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.8
Topological Polar Surface Area 69.56
Polarizability 18.13
Ring Count 1
Rotatable Bond Count 4

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OTAVA LTD.
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Purity LeadTime Formula PacketSize UnitPrice
95% <10 Days C9H11NO3 $162.27$162.27
MFCD01661528
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98% <10 Days C9H11NO3 Quote Only
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