Dihydroavenanthramide D
Properties
- Molecular formula
- C16H15NO4
- Molar mass
- 285.30 g/mol
- Exact mass
- 285.1001 Da
- logP
- 3.31Crippen estimate
- Polar surface area
- 90.1 Ų
- H-bond donors / acceptors
- 3 / 3
- Rotatable bonds
- 5
Hazards
Warning
- H317 May cause an allergic skin reaction100% of notifiers
Aggregated from 36 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, P501
Identifiers
CAS number
697235-49-7SMILES
O=C(O)c1ccccc1N=C(O)CCc1ccc(O)cc1InChIKey
DLFOKZQWYFNKCL-UHFFFAOYSA-NInChI
InChI=1S/C16H15NO4/c18-12-8-5-11(6-9-12)7-10-15(19)17-14-4-2-1-3-13(14)16(20)21/h1-6,8-9,18H,7,10H2,(H,17,19)(H,20,21)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Benzoic acid, 2-[[3-(4-hydroxyphenyl)-1-oxopropyl]amino]-
- 2-[[3-(4-Hydroxyphenyl)-1-oxopropyl]amino]benzoic acid
- Symcalmin
Work with Dihydroavenanthramide D
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Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds