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1-Propanesulfonic acid, 3-(bis(2-hydroxyethyl)amino)-2-hydroxy-

HCID 100210
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
68399-80-4
Standard SMILES
O=S(=O)(O)CC(O)CN(CCO)CCO
InChIKey
XCBLFURAFHFFJF-UHFFFAOYSA-N
Molecular formula
C7H17NO6S
Average molar mass
243.28 g/mol
Monoisotopic mass
243.07765844

Names & identifiers

Preferred name
1-Propanesulfonic acid, 3-(bis(2-hydroxyethyl)amino)-2-hydroxy-
IUPAC
3-[bis(2-hydroxyethyl)amino]-2-hydroxypropane-1-sulfonic acid
English name
DIPSO
Molecular formula
C7H17NO6S
Molecular weight
243.28

Names & synonyms

DIPSONSC 3781451-Propanesulfonic acid, 3-[bis(2-hydroxyethyl)amino]-2-hydroxy-K9ARD8RDK3EINECS 269-992-23-(Bis(2-hydroxyethyl)amino)-2-hydroxypropanesulphonic acid3-(N-Bis(hydroxyethyl)amino)-2-hydroxypropanesulfonic acidN,N-Bis(2-hydroxyethyl)-3-amino-2-hydroxypropanesulfonic acidNSC-3781451-Propanesulfonic acid, 3-(bis(2-hydroxyethyl)amino)-2-hydroxy-3-[bis(2-hydroxyethyl)amino]-2-hydroxypropanesulphonic acidDTXSID20887355
Show more names
3-(BIS(2-HYDROXYETHYL)AMINO)-2-HYDROXY-1-PROPANESULFONIC ACIDbuffergradeDIPSO bufferDIPSO FREE ACIDDIPSO ULTRAPUREDIPSO SIGMAULTRA3-[bis(2-hydroxyethy
RefChem:436178DTXCID708726551-Propanesulfonic acid, 3-bis(2-hydroxyethyl)amino-2-hydroxy-68399-80-43-(Bis(2-hydroxyethyl)amino)-2-hydroxypropane-1-sulfonic acid3-[N,N-Bis(2-hydroxyethyl)amino]-2-hydroxypropanesulfonic Acid3-[bis(2-hydroxyethyl)amino]-2-hydroxypropane-1-sulfonic acidC7H17NO6S

Properties

Computed structural properties

XLogP
-5.1
Topological polar surface area
127 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
15
Formal charge
0
Complexity
243

Physicochemical properties

Melting point
189 · 189-192 °C(lit.)
Density
1.494 · 1.494±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
solubility
2 O: · H2O: 0.1 M at 20 °C, clear, colorless
form
powder to crystal
color
White to Almost white
PH
4 · 4.0-5.5 (20℃, 0.1M in H2O)
pka
7.6 · 7.6(at 25℃)
PH Range
7 · 7.0 - 8.2
Water Solubility
almost transparency
BRN
2105454 · 2105454
Major Application
diagnostic assay manufacturing
InChI
InChI=1S/C7H17NO6S/c9-3-1-8(2-4-10)5-7(11)6-15(12,13)14/h7,9-11H,1-6H2,(H,12,13,14)
InChIKey
XCBLFURAFHFFJF-UHFFFAOYSA-N
SMILES
C(S(O)(=O)=O)C(O)CN(CCO)CCO
CAS DataBase Reference

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 66.7% (2 of 3) of all reports.

Warning

H315 (33.3%): 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 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information1-Propanesulfonic acid, 3-bis(2-hydroxyethyl)amino-2-hydroxy-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesSkin Irrit. 2 (33.3%)

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
tsca
TSCA listed
hs_code
29221980
risk_code
10-36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
F,Xi
safety_code
24/25-36-26-16-7/9
hazard_class
IRRITANT
Storage Class
11 - Combustible Solids

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1-Propanesulfonic acid, 3-[bis(2-hydroxyethyl)amino]-2-hydroxy-: ACTIVE
Applications · 2 items

DescriptionDIPSO is a Zwitterionic buffer useful in the pH range of 7.0-8.2. Studies have shown that using one buffer limits the ability to adjust the buffer capacity range. To increase the range of buffer capacity, it is more helpful to combine multiple buffers such as HEPES (sc-29097), MOPS (sc-301170), and DIPSO. This method both expands the pH buffer range and reduces toxicity by reducing the concentration of a single component.

UsesDIPSO, also known as 3-[N,N-Bis(2-hydroxyethyl)amino]-2-hydroxy-1-propanesulfonic acid, is a Zwitterionic buffer useful in the pH range of 7.0-8.2.

Suppliers100 total

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
湖北博杰生物科技有限公司0713-2060728 15629612610 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海康朗生物科技有限公司021-61998208 18217752821 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]

Related reactions

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Compound notes

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

Database identifiers

CAS
68399-80-4
PubChem CID
100210
DTXSID
DTXSID20887355
UNII
K9ARD8RDK3
EC Number
269-992-2
Nikkaji
J254.931J
68399 · 68399-80-4(CAS DataBase Reference)
FDA UNII
9 ARD8RDK3 · K9ARD8RDK3
EPA Substance Registry System
1 · 1-Propanesulfonic acid, 3-[bis(2-hydroxyethyl)amino]-2-hydroxy- (68399-80-4)
Absorption
0.025 at · ≤0.025 at 260 in H2O at 0.1M≤0.025 at 280 in H2O at 0.1M
UNSPSC Code
12161700 · 12161700
NACRES
25 · NA.25
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
335 · H335-H315-H319
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
PPE
95 · Eyeshields, Gloves, type N95 (US)
Hazard Codes
F,Xi
Risk Statements
10 · 10-36/37/38
Safety Statements
24 · 24/25-36-26-16-7/9
WGK Germany
3 · 3
TSCA
TSCA listed
HazardClass
IRRITANT
HS Code
29221980 · 29221980
Storage Class
11 · 11 - Combustible Solids
Hazard statements
H335-H315-H319
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
INTATRADE GmbH
+49 3493/605464 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
上海如吉生物科技发展有限公司+86-21-65211385-8001 36031160 · [email protected]
科瑞迪化学400-821-5857 021-64326257 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
上海晶抗生物工程有限公司021-54721350 13524668266 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
斯百全化学(上海)有限公司021-021-021-67601398-809-809-809 15221380277 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
南京杜莱生物技术有限公司025-84699383-8003;025-846993838003-8003 18013301590 · [email protected]
上海倍卓生物科技有限公司021-61119791,13386096464 · [email protected]
上海将来实业股份有限公司021-61552785 · [email protected]
北京奥秘佳得医药科技有限公司+86-13522808617 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
苏州朗行生物科技有限公司0512-62968256 18550502935 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
桦特昇生物科技(武汉)有限公司027-59207879 1972026995 18140587686 · [email protected]
康迪斯化工(湖北)有限公司13343438265 · [email protected]
TargetMol中国(陶术生物)021-021-33632979 15002134094 · [email protected]
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
北京诺其雅盛生物科技有限公司4000-819-385 010-62329685 13718666987
九鼎化学(上海)科技有限公司4009209199 · [email protected]
湖南汇百益新材料有限公司400-0909710 13319523173 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
成都润泽本土化工有限公司028-88469284 18000562381 · [email protected]
上海炎泽化工有限公司15345144255 19901447308 · [email protected]
艾万拓威达优尔国际贸易(上海)有限公司400-821-8006 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
湖北阡陌生物科技有限公司0711-3812399 18062309155 · [email protected]
武汉市承天精细化工有限公司18164098996 · [email protected]