Home Carboxes 1136-45-4
1136-45-4,MFCD00003153
Catalog No.:AA00091J
1136-45-4 | 5-Methyl-3-phenylisoxazole-4-carboxylic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$11.00   $8.00
- +
5g
98%
in stock  
$34.00   $24.00
- +
25g
95%
in stock  
$103.00   $72.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00091J
Chemical Name:
5-Methyl-3-phenylisoxazole-4-carboxylic acid
CAS Number:
1136-45-4
Molecular Formula:
C11H9NO3
Molecular Weight:
203.1941
MDL Number:
MFCD00003153
IUPAC Name:
5-methyl-3-phenyl-1,2-oxazole-4-carboxylic acid
InChI:
InChI=1S/C11H9NO3/c1-7-9(11(13)14)10(12-15-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,13,14)
InChI Key:
PENHKTNQUJMHIR-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(C)onc1c1ccccc1
EC Number:
214-497-9
UNII:
ZL8HD4RP5B
NSC Number:
76870
Properties
Computed Properties
 
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.058g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.197g/mol
Monoisotopic Mass:
203.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Synonyms
 
5-methyl-3-phenylisoxazole-4-carboxylic acid 
5-Methyl-3-phenylisoxazole-4-carboxylic acid 
5-Methyl-3-phenyl-isoxazole-4-carboxylic acid 
EINECS 214-497-9 
UNII-ZL8HD4RP5B 
NSC 76870 
ZL8HD4RP5B 
BRN 0164939 
PENHKTNQUJMHIR-UHFFFAOYSA-N 
3-Phenyl-5-methylisoxazol-4-carbonsaeure [German] 
MFCD00003153 
5-Methyl-3-phenyl-4-isooxazolic acid 
1136-45-4 
5-METHYL-3-PHENYL-4-ISOXAZOLIC ACID 
Pmic acid 
NSC76870 
PubChem8661 
rarechem al be 0514 
AC1Q2DJV 
timtec-bb sbb010075 
ACMC-1C3JN 
Cambridge id 5229752 
akos bbs-00003754 
4-Isoxazolecarboxylic acid, 5-methyl-3-phenyl- 
CBDivE_008536 
4-27-00-04087 (Beilstein Handbook Reference) 
KSC175K7F 
ARONIS24361 
SCHEMBL316093 
3-Phenyl-5-methylisoxazol-4-carbonsaeure [German] 
AC1L23N1 
Jsp001049 
DTXSID3061556 
WLN: T5NOJ C1 DVQ ER 
5-methyl-3-phenyl-1,2-oxazole-4-carboxylic acid 
CTK0H5572 
HMS1631N05 
HMS3447E18 
ZINC158490 
KS-00000YW4 
ANW-16652 
BBL005244 
CM-385 
NSC-76870 
SBB010075 
5-Methyl-3-phenyl-4-isoxazolecarboxylic acid 
STK177355 
AKOS000120854 
8P-396S 
AN-2584 
CCG-142813 
MCULE-9173272820 
RP04408 
RTR-040142 
SDCCGMLS-0065903.P001 
VZ35667 
3-Phenyl-5-methylisoxazol-4-carbonsaeure 
AJ-15197 
BAS 00532226 
BR-29789 
LS-86647 
Q655 
SC-00427 
5-methyl-3-phenyl-4-isoxazolecarboxylicaci 
5-methyl-3-phenyl-4-isoxazolecarboxylicacid 
DB-041181 
TR-040142 
3-Phenyl-5-methylisoxazole-4-carboxylic acid 
1-(4-Carboxy-5-methylisoxazol-3-yl)benzene 
5-methyl-3-phenylisoxazole-4-carboxlic acid 
A2312 
FT-0620628 
ST24029524 
ST45244474 
UPCMLD00X1136-45-4:001 
UPCMLD00X1136-45-4:002 
3-phenyl-5-methyl-4-isoxazolecarboxylic acid 
5-Methyl-3-phenylisooxazole-4-carboxylic acid 
5-methyl-3-phenylisoxazole-4-carboxylicacid 
S-1487 
5-METHYL-3-PHENYLISOXAZOLE-4-CARBOXYLIC 
AQ-360/40723605 
5-Methyl-3-phenylisoxazole-4-carboxylic acid, 99% 
I14-4378 
W-108615 
Z262222238 
Oxacillin Related Compound C, United States Pharmacopeia (USP) Reference Standard 
MOK 
C11H9NO3 
ISOXAZOLE-4-CARBOXYLIC ACID, 5-METHYL-3-PHENYL- 
C11-H9-N-O3 
CID14343 
3-phenyl-5-methyl-Isoxazole-4-carboxylic acid 
(2S)-1,3,4,5,6,7-Hexahydro-1,1,5,5-tetramethyl-2H-2,4a-methanonaphthalene 
Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Additional Info:
Q & A