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3-Aminophthalic acid hydrochloride
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
217.014185416
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₈H₇NO₄·HCl
0 references
canonical SMILES
Cl.Nc1cccc(C(=O)O)c1C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C8H7NO4.ClH/c9-5-3-1-2-4(7(10)11)6(5)8(12)13;/h1-3H,9H2,(H,10,11)(H,12,13);1H
0 references
InChIKey
ZBZAVEORKXFUQB-UHFFFAOYSA-N
0 references
CAS Registry Number
6946-22-1
1 reference
InChIKey
ZBZAVEORKXFUQB-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=6946-22-1
PubChem CID
81375
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
24450424
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID3064514
0 references
DSSTOX compound identifier
DTXCID0046513
0 references
NSC number
56716
0 references
127008
0 references
EC number
230-106-4
0 references
ECHA Substance Infocard ID
100.027.370
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.027.370
retrieved
29 December 2019
title
3-aminophthalic acid hydrochloride
(English)
quotation
CAS no.: 6946-22-1
(English)
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