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Croceic acid

HCID 67237
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
132-57-0
Standard SMILES
O=S(=O)(O)c1cccc2ccc(O)cc12
InChIKey
HUYJTJXLNBOVFO-UHFFFAOYSA-N
Molecular formula
C10H8O4S
Average molar mass
224.23 g/mol
Monoisotopic mass
224.01432991

Names & identifiers

Preferred name
Croceic acid
IUPAC
7-hydroxynaphthalene-1-sulfonic acid
English name
7-hydroxynaphthalene-1-sulphonic acid
Molecular formula
C10H8O4S
Molecular weight
224.23

Names & synonyms

Croceic acid132-57-0Bayer's Acid1-Naphthalenesulfonic acid, 7-hydroxy-7-hydroxy-1-naphthalenesulfonic acidM1490B3Z3GDTXSID90596267-hydroxy-1-naphthalenesulphonic acid7-HNS acidRefChem:128501DTXCID9034076205-066-6
Show more names
7-hydroxynaphthalene-1-sulfonic acid7-Hydroxynaphthalene-1-sulphonic acid2-naphthol-8-sulfonic acidUNII-M1490B3Z3GEINECS 205-066-6CROCEINE ACIDCROCEIN ACID2-Naphthol-8-sulfosaure

Database identifiers

CAS
132-57-0
PubChem CID
67237
DTXSID
DTXSID9059626
UNII
M1490B3Z3G
EC Number
205-066-6
Nikkaji
J5.572G

Properties

Computed structural properties

XLogP
1
Topological polar surface area
83 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
15
Formal charge
0
Complexity
319

Physicochemical properties

Boiling point
335.63 °C · 335.63°C (rough estimate)
Density
1.4643 · 1.4643 (rough estimate)
refractive index
1.54 · 1.5400 (estimate)
pka
0.26 · 0.26±0.40(Predicted)
FDA UNII
1490 B3Z3G · M1490B3Z3G
EPA Substance Registry System
1 · 1-Naphthalenesulfonic acid, 7-hydroxy- (132-57-0)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319-H315
Precautionary statements
264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
TSCA
TSCA listed
REACH Registrations
Active

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 · 5 items

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

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

Hazard information

Regulatory InformationREACH registered substance: 7-hydroxynaphthalene-1-sulphonic acid (EC: 205-066-6)
Hazard Classes and CategoriesSkin Irrit. 2 (50%)

Safety data

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

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1-Naphthalenesulfonic acid, 7-hydroxy-: INACTIVE

Applications

UsesUsed as an intermediate of acid dyes and direct azo dyes.

Preparation methods

Preparation7-hydroxynaphthalene-1-sulphonic acid was prepared by sulfonation of 2-naphthol with 98% sulfuric acid at low temperature.

Upstream & downstream products

Upstream raw materials

2-Naphthol-8-sulfonic acid potassium salt6-Hydroxynaphthalene-2-sulphonic acid

Downstream products

disodium 7-hydroxy-8-[[4-[(4-sulphonatophenyl)azo]phenyl]azo]naphthalene-2-sulphonate4-Hydroxy-3-[[4'-[(2-hydroxy-8-sodiosulfo-1-naphthalenyl)azo]-1,1'-biphenyl-4-yl]azo]naphthalene-2,5-disulfonic acid disodium saltIRGALAN BORDEAUX ELamanil developed black bhsw7-Hydroxy-8-[[2-methoxy-4-[(4-sodiosulfophenyl)azo]phenyl]azo]naphthalene-1-sulfonic acid sodium saltChloramine Rubine7-Hydroxy-8-[(4-sulfo-1-naphthalenyl)azo]-1-naphthalenesulfonic acid disodium saltCROCEIN SCARLET 7BNaphthalenesulfonic acid, 2-hydroxy-1-[[2-methyl-4-[(2-methylphenyl)azo]phenyl]azo]-, monosodium saltDirect Blue 45disodium 8,8'-[[1,1'-biphenyl]-4,4'-diylbis(azo)]bis(7-hydroxynaphthalene-1-sulphonate)

Suppliers5 total

青岛海智微元生物科技有限公司18317699790 18317699790 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

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Compound notes

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