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Benzoic acid, 2-(ethylamino)-5-sulfo-

HCID 67063
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
119-22-2
Standard SMILES
CCNc1ccc(S(=O)(=O)O)cc1C(=O)O
InChIKey
WXUAZZARGUDIHU-UHFFFAOYSA-N
Molecular formula
C9H11NO5S
Average molar mass
245.25 g/mol
Monoisotopic mass
245.03579362

Names & identifiers

Preferred name
Benzoic acid, 2-(ethylamino)-5-sulfo-
IUPAC
2-(ethylamino)-5-sulfobenzoic acid
English name
N-ethyl-5-sulphoanthranilic acid
Molecular formula
C9H11NO5S
Molecular weight
245.25234

Names & synonyms

2-(ethylamino)-5-sulfobenzoic acidBenzoic acid, 2-(ethylamino)-5-sulfo-N-Ethyl-5-sulphoanthranilic acid2-Ethylamino-5-sulfobenzoic acidAnthranilic acid, N-ethyl-5-sulfo-EINECS 204-307-2NSC 16161DTXSID2059483RefChem:565453DTXCID5033460Anthranilic acid, N-ethyl-5-sulfo-(8CI)204-307-2
Show more names
N-Ethyl-5-sulfoanthanilic acid2-Ethylamino-5-sulfobenzoesure
119-22-2N-Ethyl-5-sulfoanthranilic acidNSC16161SCHEMBL33190725- Sulfo-2-athylaminobenzoesaureWXUAZZARGUDIHU-UHFFFAOYSA-NNSC49120NSC-16161

Database identifiers

CAS
119-22-2
PubChem CID
67063
DTXSID
DTXSID2059483
EC Number
204-307-2
Nikkaji
J168.621F

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
112 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
347

Physicochemical properties

EPA Substance Registry System
2 · Benzoic acid, 2-(ethylamino)-5-sulfo- (119-22-2)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
335 · H335-H319-H315
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H335-H319-H315
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationBenzoic acid, 2-(ethylamino)-5-sulfo-: INACTIVE

Suppliers1 total

陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes