2-aminoethanol;2-hydroxybenzoic acid

C9H13NO4 — CID 3085170

IUPAC2-aminoethanol;2-hydroxybenzoic acid
SMILESNCCO.O=C(O)c1ccccc1O
InChIInChI=1S/C7H6O3.C2H7NO/c8-6-4-2-1-3-5(6)7(9)10;3-1-2-4/h1-4,8H,(H,9,10);4H,1-3H2
InChIKeyWGPVWXXJNUNBNB-UHFFFAOYSA-N
MW199.21 g/mol
LogP0.03
Rot. Bonds2

About 2-aminoethanol;2-hydroxybenzoic acid

2-aminoethanol;2-hydroxybenzoic acid (PubChem CID 3085170) has the molecular formula C9H13NO4 and a molecular weight of 199.21 g/mol. Its IUPAC name is 2-aminoethanol;2-hydroxybenzoic acid.

Molecular Properties

Compound Name2-aminoethanol;2-hydroxybenzoic acid
PubChem CID3085170
Molecular FormulaC9H13NO4
Molecular Weight199.21 g/mol
Exact Mass199.08
IUPAC Name2-aminoethanol;2-hydroxybenzoic acid
SMILESNCCO.O=C(O)c1ccccc1O
InChIInChI=1S/C7H6O3.C2H7NO/c8-6-4-2-1-3-5(6)7(9)10;3-1-2-4/h1-4,8H,(H,9,10);4H,1-3H2
InChIKeyWGPVWXXJNUNBNB-UHFFFAOYSA-N
XLogP0.03
TPSA103.78 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.21
LogP ≤ 50.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

Salicylic Acid
CID 338
Methyl Salicylate
CID 4133
Sodium Salicylate
CID 16760658
Salicylate
CID 54675850
Ethyl Salicylate
CID 8365
Trolamine Salicylate
CID 25213
Butyl salicylate
CID 16330
Choline Salicylate
CID 54686350
(T-4)-Bis(2-(hydroxy-kappaO)benzoato-kappaO)magnesium
CID 54684589
Glycol Salicylate
CID 6880
Potassium Salicylate
CID 23664627
Zinc Salicylate
CID 54693468

Frequently Asked Questions

What is the IUPAC name of 2-aminoethanol;2-hydroxybenzoic acid?
The IUPAC name of 2-aminoethanol;2-hydroxybenzoic acid (CID 3085170) is 2-aminoethanol;2-hydroxybenzoic acid.
What is the SMILES notation for 2-aminoethanol;2-hydroxybenzoic acid?
The canonical SMILES for 2-aminoethanol;2-hydroxybenzoic acid is NCCO.O=C(O)c1ccccc1O.
What is the InChIKey of 2-aminoethanol;2-hydroxybenzoic acid?
The InChIKey is WGPVWXXJNUNBNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6O3.C2H7NO/c8-6-4-2-1-3-5(6)7(9)10;3-1-2-4/h1-4,8H,(H,9,10);4H,1-3H2.
What are the key properties of 2-aminoethanol;2-hydroxybenzoic acid?
2-aminoethanol;2-hydroxybenzoic acid has a molecular weight of 199.21 g/mol, XLogP of 0.03, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethanol;2-hydroxybenzoic acid is sourced from PubChem (CID 3085170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).