Basic information
- CAS
1135-40-6- Standard SMILES
O=S(=O)(O)CCCNC1CCCCC1- InChIKey
PJWWRFATQTVXHA-UHFFFAOYSA-N- Molecular formula
- C9.H19.N.O3.S
- Average molar mass
- 221.32 g/mol
- Monoisotopic mass
- 221.10856447
Overview
Cyclohexylaminopropanesulfonic acid is an amine.
Names & identifiers
- Preferred name
- 3-(Cyclohexylamino)-1-propanesulfonic acid
- IUPAC
- 3-(cyclohexylamino)propane-1-sulfonic acid
- English name
- 3-Cyclohexylaminopropanesulfonic Acid
- Molecular formula
- C9H19NO3S
- Molecular weight
- 221.32
Names & synonyms
Show more names
Database identifiers
- CAS
1135-40-6- PubChem CID
- 70815
- DTXSID
DTXSID3061554- ChEBI
CHEBI:191088- UNII
- 4W981O1LXP
- EC Number
- 214-492-1
- Nikkaji
- J7.274E
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 239
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 300 °C · >300 °C(lit.)
- Density
- 1.1809 · 1.1809 (rough estimate)
- bulk density
- 400 kg/m3 · 400kg/m3
- vapor pressure
- 0 Pa · 0Pa at 25℃
- refractive index
- 1.525 · 1.5250 (estimate)
- Flash point
- 110 ℃ · >110℃
- storage temp.
- room temp
- solubility
- 2 O: · H2O: 0.5 M at 20 °C, clear
- form
- Powder/Solid
- color
- White
- Odor
- Odorless
- PH Range
- 3 · 3 - 7
- PH
- 3 · 3.0-7.0 (20℃, 0.5M in H2O)
- pka
- 10.4 · 10.4(at 25℃)
- Water Solubility
- 9 g/100 · 9 g/100 mL (20 ºC)
- λmax
- 260 nm · λ: 260 nm Amax: ≤0.04λ: 280 nm Amax: ≤0.04
- Merck
- 14 · 14,1767
- BRN
- 2835588 · 2835588
- Stability
- Stable. Incompatible with strong oxidizing agents.
- InChI
- 1S/C9H19NO3S/c11-14(12,13)8-4-7-10-9-5-2-1-3-6-9/h9-10H,1-8H2,(H,11,12,13)
- InChIKey
- PJWWRFATQTVXHA-UHFFFAOYSA-N
- SMILES
- OS(=O)(=O)CCCNC1CCCCC1
- LogP
- 0.3 at · 0.3 at 25℃
- CAS DataBase Reference
- 1135 · 1135-40-6(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 4 W981O1LXP · 4W981O1LXP
- EPA Substance Registry System
- 1 · 1-Propanesulfonic acid, 3-(cyclohexylamino)- (1135-40-6)
- Absorption
- 0.2 at · ≤0.2 at 260 in H2O at 0.5M≤0.2 at 280 in H2O at 0.5M
- UNSPSC Code
- 41121821 · 41121821
- NACRES
- 32 · SB.32
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- PPE
- 95 · Eyeshields, Faceshields, Gloves, type N95 (US)
- Hazard Codes
- Xi,Xn
- Risk Statements
- 36 · 36/38-36/37/38-22-20/21/22-40/22
- Safety Statements
- 26 · 26-36/37/39-37/39-24/25-22-23-36
- WGK Germany
- 3 · 3
- RTECS
- 6395000 · TZ6395000
- F
- 34 · 34
- TSCA
- TSCA listed
- HS Code
- 29213099 · 29213099
- Storage Class
- 11 · 11 - Combustible Solids
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 85.9% (67 of 78) of all reports.
Warning
H315 (11.5%): 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 78 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Status: Active Update: 20-08-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/20235
1-Propanesulfonic acid, 3-(cyclohexylamino)-: Does not have an individual approval but may be used under an appropriate group standard
Safety & protection
Protective Action Criteria (PAC)
12 [mg/m3]
130 [mg/m3]
790 [mg/m3]
Safety data
- F
- 34
- PPE
- Eyeshields, Faceshields, Gloves, type N95 (US)
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- TZ6395000
- hs_code
- 29213099
- risk_code
- 36/38-36/37/38-22-20/21/22-40/22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,Xn
- safety_code
- 26-36/37/39-37/39-24/25-22-23-36
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- REACH Registrations
- Active
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Uses & manufacturing
Applications
Description3-Cyclohexylaminopropanesulfonic Acid, also known as 3-(Cyclohexylamino)-1-propanesulfonic acid (CHAPS) or N-Cyclohexyl-3-aminopropanesulfonic acid, is a detergent with a high affinity for basic proteins that can be used to extract these proteins from biological samples and solubilize them. CHAPS is a type of ampholyte, which means it has both anionic and cationic groups.
Uses3-Cyclohexylaminopropanesulfonic Acid buffer salt is used to formulate CAPS buffer, a zwitterionic buffer that is useful in the range of pH 7.9-11.1. CAPS buffer is widely used in Western and immunoblotting experiments as well as protein sequencing and identification. Used in the electrotransfer of proteins to PVDF (sc-3723) or nitrocellulose membranes (sc-3718, sc-3724). The high pH of this buffer makes it useful for the transfer of proteins with a pI > 8.5. CAPS is not one of the original Good's buffers, although it has a similar structure to the other propanesulfonic acids and was selected as a highly water soluble buffering reagent with an optimum buffering pH of 10.4 and minimal reactivity with enzymes or proteins, minimal salt effects. It is a biological buffer.
Suppliers100 total
Additional notes
DefinitionChEBI: Cyclohexylaminopropanesulfonic acid is an amine.
Related reactions
Compound notes
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