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10097-02-6,MFCD00190088
Catalog No.:AA00039P
10097-02-6 | Butanoic acid, 2,2-bis(hydroxymethyl)-
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Purity
Availability
Price(USD)
Quantity
  
25g
95%
in stock  
$27.00
- +
100g
95%
in stock  
$49.00
- +
500g
95%
in stock  
$124.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00039P
Chemical Name:
Butanoic acid, 2,2-bis(hydroxymethyl)-
CAS Number:
10097-02-6
Molecular Formula:
C6H12O4
Molecular Weight:
148.1571
MDL Number:
MFCD00190088
IUPAC Name:
2,2-bis(hydroxymethyl)butanoic acid
InChI:
InChI=1S/C6H12O4/c1-2-6(3-7,4-8)5(9)10/h7-8H,2-4H2,1H3,(H,9,10)
InChI Key:
JVYDLYGCSIHCMR-UHFFFAOYSA-N
SMILES:
CCC(C(=O)O)(CO)CO
UNII:
42UJ0Z625V
Properties
Computed Properties
 
Complexity:
117  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.074g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
148.158g/mol
Monoisotopic Mass:
148.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  

Synonyms
 
10097-02-6 
2,2-bis(hydroxymethyl)butanoic acid 
J-660016 
dimethylolbutyric acid 
AC1MNBKP 
LS-181605 
ACMC-2097tk 
EC 424-090-1 
SCHEMBL39652 
KSC268K4R 
2,2-dihydroxymethylbutyric acid 
Jsp000175 
2,2-Bis(hydroxymethyl)butyric acid 
DTXSID8064939 
CTK1G8548 
JVYDLYGCSIHCMR-UHFFFAOYSA- 
2,2-bis-(Hydroxymethyl)-n-buty 
JVYDLYGCSIHCMR-UHFFFAOYSA-N 
2,2-Bis(hydroxymethyl)butyricacid 
ZINC403181 
BCP05575 
KS-00000UP3 
ZX-AT011246 
2,2-Dimethylolbutyric Acid 
ANW-14406 
FCH963935 
MFCD00190088 
OR9442 
SBB065923 
AKOS006220771 
2,2-bis(hydroxymethyl)-n-butyric acid 
AM90355 
RL00065 
RTR-000282 
Butanoic acid, 2,2-bis(hydroxymethyl)- 
2,2-bis-(Hydroxymethyl)-n-butyric acid 
AJ-21970 
AK114519 
S994 
SC-47214 
2,2-Bis(hydroxymethyl)butyric acid, 98% 
AX8064312 
ST2415584 
TR-000282 
FT-0609186 
Dimethylol butanoic acid 
A800306 
C-42393 
I04-0862 
J-506779 
2,2-Bis(hydroxymethyl)butyric acid, Vetec(TM) reagent grade, 98% 
InChI=1/C6H12O4/c1-2-6(3-7,4-8)5(9)10/h7-8H,2-4H2,1H3,(H,9,10) 
56743-27-2 
none 
Dimethylolbutanoic Acid(DMBA) 
C6H12O4 
UNII-42UJ0Z625V 
2,2-Bis(hydroxymethyl) butyric acid 
C6-H12-O4 
ACN-037881 
CID3301396 
B2038 
2,2-Bis(hydroxymethyl)butyric acid, 99% - 100G 100g 
2,2'-Bis(hydroxymethyl)butyric acid 
42UJ0Z625V 
Butanoic acid, bis(hydroxymethyl)- 
Literature
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