CAS
25343-91-3 Purity
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25343-91-3 Purity
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Gentisuric acid
CAS
25351-24-0
Catalog Number
ACM25351240
Category
Other Products
Molecular Weight
211.17
Molecular Formula
C9H9NO5
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Specification
Synonyms
Gentisuric acid, 2,5-Dihydroxyhippuric acid, 2,5-Dihydroxybenzoyl-N-glycine, N-(2,5-Dihydroxybenzoyl)glycine, CID161488, [(2,5-Dihydroxybenzoyl)amino]acetic acid, G0220, 25351-24-0
IUPAC Name
2-[(2,5-dihydroxybenzoyl)amino]acetic acid
Canonical SMILES
C1=CC(=C(C=C1O)C(=O)NCC(=O)O)O
InChI Key
FBFATOOJCPDQOZ-UHFFFAOYSA-N
Boiling Point
530.1ºC at 760mmHg
Flash Point
274.4ºC
Density
1.532g/cm³
Exact Mass
211.04800
H-Bond Acceptor
5
H-Bond Donor
4
Upstream Synthesis Route 1
- 1107608-87-6
- 25351-24-0
Reference: [1]Lienard, Benoit M.; Conejo-Garcia, Ana; Stolze, Ineke; Loenarz, Christoph; Oldham, Neil J.; Ratcliffe, Peter J.; Schofield, Christopher J.
[Chemical Communications, 2008, # 47, p. 6393 - 6395]
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