Encyclopedia
EN
ZH
EN
ES
FR
DE
KR
JP
Sign in
|
Join Free
Category
Organic Intermediates
Pharmaceuticals and Biochemicals
Basic Organic Chemicals
Agrochemicals
Inorganic Chemicals
Catalyst and Auxiliary
Custom Manufacturing
Food & Feed Additives
Daily Chemicals
Dyestuffs and Pigments
Laboratory Chemicals
Adhesives and Sealants
Flavour & Fragrance
Paint and Coatings
Polymer
Metals and Minerals
Encyclopedia
Chemicals Encyclopedia
Cosmetic Ingredients
Dictionary
English
Deutsch
Français
Español
日本語
한국어
Supplier
Buyer Request
TradeShow
FAQs
Structure Search
About Us
Encyclopedia
/
Pharmaceutical Intermediates
/
Organic Intermediate
Sodium 3-hydroxypropane-1-sulphonate
CAS:
3542-44-7
MW:
162.13
MF:
C3H7NaO4S
 
Email
 
Tweet
 
Share
Names and ldentifier
Msds
NMR Spectrum
Computational chemical data
Realated Product Infomation
1. Names and Identifiers
1.1 Name
Sodium 3-hydroxypropane-1-sulphonate
1.2 Synonyms
1-HYDROXYPROPANE-3-SULFONIC ACID SODIUM SALT; 1-Propanesulfonic acid, 3-hydroxy-, sodium salt (1:1); 1-Propanesulfonic acid,3-hydroxy-, sodium salt (1:1); 3-HYDROXY-1-PROPANESULFONIC ACID, SODIUM SALT; 3-hydroxy-1-propanesulfonicacimonosodiumsalt; 3-Hydroxypropane-1-sulfonic acid sodium salt; Hpsna3-HydroxypropanesulfonicAcid,SodiumSalt; Sodium 3-sulfo-1-propanolate;
View all
1.3 CAS No.
3542-44-7
1.4 CID
23687212
1.5 EINECS
222-584-8
1.6 Molecular Formula
C3H7NaO4S
1.7 Inchi
InChI=1S/C3H8O4S.Na/c4-2-1-3-8(5,6)7;/h4H,1-3H2,(H,5,6,7);/q;+1/p-1
1.8 InChkey
CSKVLUWCGPWCQR-UHFFFAOYSA-M
1.9 Canonical Smiles
[Na+].OCCCS([O-])(=O)=O
1.10 Isomers Smiles
C(CO)CS(=O)(=O)[O-].[Na+]
2. MSDS
2.
Hazard identification
2.1
Classification of the substance or mixture
no data available
2.2
GHS label elements, including precautionary statements
Pictogram(s)
no data available
Signal word
no data available
Hazard statement(s)
no data available
Precautionary statement(s)
Prevention
no data available
Response
no data available
Storage
no data available
Disposal
no data available
2.3
Other hazards which do not result in classification
no data available
View all
3. NMR Spectrum
13C NMR : Predict
1H NMR : Predict
4. Synthesis Route
3542-44-7
Total: 3 Synthesis Route
1120-71-4
319 Suppliers
3542-44-7
14 Suppliers
1120-71-4
319 Suppliers
51034-39-0
3542-44-7
14 Suppliers
5. Precursor and Product
precursor:
1120-71-4
503-30-0
7757-83-7
product:
4720-61-0
1633-82-5
6. Computed Properties
Molecular Weight:
162.13g/mol
Molecular Formula:
C
3
H
7
NaO
4
S
Compound Is Canonicalized:
True
XLogP3-AA:
161.99627416
Monoisotopic Mass:
161.99627416
Complexity:
134
Rotatable Bond Count:
3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Topological Polar Surface Area:
85.8
Heavy Atom Count::
9
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Isotope Atom Count:
0
Covalently-Bonded Unit Count:
2
CACTVS Substructure Key Fingerprint:
AAADcYBAOCBAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgQACAAACACkwAKAAAAAAgIAAAAAAHBAAAAAAAAAAAAAAAAAEAAAAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
7. Toltal 13 Suppliers
View more
Henan Tianfu Chemical Co.,Ltd
1YR
Tel:
Update Time:
2024/11/15
inquire
Shijiazhuang Sdyano Fine Chemical Co., Ltd
Tel:
Update Time:
2019/04/01
inquire
Shanghai Sphchem Co., Ltd
Tel:
Update Time:
2019/02/26
inquire
Shanghai Yuanye Bio
Tel:
Update Time:
2019/02/23
inquire
stonelakepharm Tec Co,Ltd
Tel:
Update Time:
2012/11/19
inquire
8. Realated Product Infomation
2-Hydroxypropane-2-Sulphonic Acid
cas:7785-42-4
PANTOPRAZOLE SULPHONE SODIUM SALT
cas:127780-16-9
Sodium salt of polynaphthalene sulphonic acid
cas:36290-04-7
Sodium 5-hydroxynaphthalene-1-sulphonate
cas:5419-77-2
sodium 8-aminonaphthalene-2-sulphonate
cas:6322-37-8
sodium 4-bromobutane-1-sulphonate
cas:53535-08-3
1. Names and Identifiers
1.1 Name
1.2 Synonyms
1.3 CAS No.
1.4 EINECS(EC#)
1.5 Molecular Formula
1.6 Inchi
1.7 InChkey
1.8 Canonical Smiles
1.9 Isomers Smiles
2.
Msds
3.
NMR Spectrum
4.
Synthesis Route
5.
Precursor and Product
6.
Computational chemical data
7.
Toltal 13 Suppliers
8.
Realated Product Infomation
Cancel
CAS
Products
Suppliers
Popular Searches
Request For Quotation