1-propanaminium, n,n-dimethyl-n-(3-((2-methyl-1-oxo-2-propen-1-yl)amino)propyl)-3-sulfo-, inner salt

HCID 78883
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Basic information

CAS
5205-95-8
Standard SMILES
C=C(C)C(=O)NCCC[N+](C)(C)CCCS(=O)(=O)[O-]
InChIKey
OIETYYKGJGVJFT-UHFFFAOYSA-N
Molecular formula
C12H24N2O4S
Average molar mass
292.4 g/mol

Names & identifiers

Preferred name
1-propanaminium, n,n-dimethyl-n-(3-((2-methyl-1-oxo-2-propen-1-yl)amino)propyl)-3-sulfo-, inner salt
IUPAC
3-[dimethyl-[3-(2-methylprop-2-enoylamino)propyl]azaniumyl]propane-1-sulfonate
English name
3-Sulfopropyldimethyl-3-methacrylamidopropylammonium inner salt
Molecular formula
C12H24N2O4S
Molecular weight
292.39

Names & synonyms

5205-95-8EINECS 226-003-91-Propanaminium, N,N-dimethyl-N-[3-[(2-methyl-1-oxo-2-propen-1-yl)amino]propyl]-3-sulfo-, inner salt1-Propanaminium, N,N-dimethyl-N-(3-((2-methyl-1-oxo-2-propen-1-yl)amino)propyl)-3-sulfo-, inner saltRefChem:771043-[dimethyl-[3-(2-methylprop-2-enoylamino)propyl]azaniumyl]propane-1-sulfonateMFCD000806423-SULFOPROPYLDIMETHYL-3-METHACRYLAMIDOPROPYLAMMONIUMINNERSALT[3-(Methacryloylamino)propyl]dimethyl(3-sulfopropyl)ammonium hydroxide inner salt3-[(3-Methacrylamidopropyl)dimethylammonio]propane-1-sulfonate3-{dimethyl[3-(2-methylprop-2-enamido)propyl]azaniumyl}propane-1-sulfonateN-(3-Sulfopropyl)-N-methacryloylamidopropyl-N,N-dimethylammonium betaine
Show more names
SPPDK015DMMPPSRalu Mer SPPAcrylic water-based monomer(3-(methacryloylamino)propyl)dimethyl-(3-sulfopro-Sulfopropyldimethyl-3-methacrylamidopropylammonium inner sa3-(Methacryloylamino)propyldimethyl(3-sulfonatopropyl)aminium3-(Methacryloylamino)propyl(3-sulfonatopropyl)dimethylaminium
3-((3-Methacrylamidopropyl)Dimethylammonio)Propane-1-SulfonateDimethyl(3-((2-methyl-1-oxoallyl)amino)propyl)-3-sulphopropylammonium hydroxideSCHEMBL35104AKOS015894700AS-49361SY122227U0119H11327

Database identifiers

CAS
5205-95-8
PubChem CID
78883
EC Number
226-003-9
Nikkaji
J297.940C

Properties

Computed structural properties

XLogP
0.1
Topological polar surface area
94.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
19

Physicochemical properties

Melting point
190 °C · 190 °C (dec.)(lit.)
form
solid
color
White
InChI
InChI=1S/C12H24N2O4S/c1-11(2)12(15)13-7-5-8-14(3,4)9-6-10-19(16,17)18/h1,5-10H2,2-4H3,(H-,13,15,16,17,18)
InChIKey
OIETYYKGJGVJFT-UHFFFAOYSA-N
SMILES
[N+](C)(C)(CCCNC(=O)C(=C)C)CCCS([O-])(=O)=O

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]

P203, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P317, P318, P321, P332+P317, P337+P317, P362+P364, P405, and P501 (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 InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesAcute Tox. 4 (50%)

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
tsca
TSCA listed
hs_code
2924190090
risk_code
20/21/22-34
Signal word
Warning

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1-Propanaminium, N,N-dimethyl-N-[3-[(2-methyl-1-oxo-2-propen-1-yl)amino]propyl]-3-sulfo-, inner salt: ACTIVE

Applications

General Description3-SULFOPROPYLDIMETHYL-3-METHACRYLAMIDOPROPYLAMMONIUM INNER SALT is a zwitterionic methacrylamide monomer that balances hydrophilic and ionic interactions, making it valuable in bioelectronics, water treatment, and anti-fouling coatings.

Suppliers100 total

郑州阿尔法化工有限公司+86-18530059196 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
武汉吉和昌国际贸易有限公司+86-83527060; +86-13972901456 · [email protected]
淄博茵泰医药科技有限公司18766946537 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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