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Details

Stereochemistry ACHIRAL
Molecular Formula C6H12O4
Molecular Weight 148.1571
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2-BIS(HYDROXYMETHYL)BUTANOIC ACID

SMILES

CCC(CO)(CO)C(O)=O

InChI

InChIKey=JVYDLYGCSIHCMR-UHFFFAOYSA-N
InChI=1S/C6H12O4/c1-2-6(3-7,4-8)5(9)10/h7-8H,2-4H2,1H3,(H,9,10)

HIDE SMILES / InChI
Molecular Formula C6H12O4
Molecular Weight 148.1571
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
139594
PubMed

PubMed

TitleDatePubMed
Patents

Patents

JP2000063746A
1
JP2000327953A
2
JP2000344890A
1
JP2001011413A
1
JP2001055538A
1
JP2002226426A
1
JP2003286220A
1
JP2004314060A
1
JP2005146089A
1
JP2005240023A
1
JP2006283009A
1
JP2007031661A
1
JP2007106797A
1
JP2008138213A
1
JP2008506830A
1
JP2009523922A
2
JP4643643B2
2
JPH08165408A
1
JPH08259884A
1
JPH0827242A
1
JPH09157473A
1
JPH0952925A
1
JPH10265539A
1
JPH10298251A
1
JPH11171956A
1
JPH11349914A
1
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:41:28 GMT 2023
Edited
by admin
on Fri Dec 15 18:41:28 GMT 2023
Record UNII
42UJ0Z625V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2-BIS(HYDROXYMETHYL)BUTANOIC ACID
Systematic Name English
2,2-DIMETHYLOLBUTANOIC ACID
Systematic Name English
BUTANOIC ACID, 2,2-BIS(HYDROXYMETHYL)-
Common Name English
DIMETHYLOLBUTYRIC ACID
Systematic Name English
NIKKAMER BA
Brand Name English
BIS(HYDROXYMETHYL)BUTANOIC ACID, 2,2-
Common Name English
2,2-DIMETHYLOLBUTYRIC ACID
Systematic Name English
DIMETHYLOLBUTANOIC ACID
Systematic Name English
DIMETHYLOLBUTYRIC ACID [INCI]
Common Name English
Classification Tree Code System Code
Food Contact Sustance Notif, (FCN No.) FCN NO. 766
Created by admin on Fri Dec 15 18:41:28 GMT 2023 , Edited by admin on Fri Dec 15 18:41:28 GMT 2023
Food Contact Sustance Notif, (FCN No.) FCN NO. 448
Created by admin on Fri Dec 15 18:41:28 GMT 2023 , Edited by admin on Fri Dec 15 18:41:28 GMT 2023
Food Contact Sustance Notif, (FCN No.) FCN NO. 37
Created by admin on Fri Dec 15 18:41:28 GMT 2023 , Edited by admin on Fri Dec 15 18:41:28 GMT 2023
Code System Code Type Description
FDA UNII
42UJ0Z625V
Created by admin on Fri Dec 15 18:41:28 GMT 2023 , Edited by admin on Fri Dec 15 18:41:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID8064939
Created by admin on Fri Dec 15 18:41:28 GMT 2023 , Edited by admin on Fri Dec 15 18:41:28 GMT 2023
PRIMARY
CAS
10097-02-6
Created by admin on Fri Dec 15 18:41:28 GMT 2023 , Edited by admin on Fri Dec 15 18:41:28 GMT 2023
PRIMARY
PUBCHEM
3301396
Created by admin on Fri Dec 15 18:41:28 GMT 2023 , Edited by admin on Fri Dec 15 18:41:28 GMT 2023
PRIMARY
NIH
NCATS
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