Home Amines 33866-48-7
33866-48-7,MFCD01569450
Catalog No.:AA003I1B
33866-48-7 | 5-Amino-3-(4-chlorophenyl)isoxazole
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1g
≥ 99% (HPLC)
1 week  
$136.00   $95.00
- +
5g
≥ 99% (HPLC)
1 week  
$349.00   $245.00
- +
25g
≥ 99% (HPLC)
1 week  
$1,304.00   $913.00
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  • Technical Information
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Technical Information
Catalog Number:
AA003I1B
Chemical Name:
5-Amino-3-(4-chlorophenyl)isoxazole
CAS Number:
33866-48-7
Molecular Formula:
C9H7ClN2O
Molecular Weight:
194.6177
MDL Number:
MFCD01569450
IUPAC Name:
3-(4-chlorophenyl)-1,2-oxazol-5-amine
InChI:
InChI=1S/C9H7ClN2O/c10-7-3-1-6(2-4-7)8-5-9(11)13-12-8/h1-5H,11H2
InChI Key:
KRQFEURBUJROHA-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1noc(c1)N
Properties
Computed Properties
 
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.025g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.618g/mol
Monoisotopic Mass:
194.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

Synonyms
 
3-(4-chlorophenyl)isoxazol-5-amine 
33866-48-7 
AC1Q51JU 
SCHEMBL474171 
CTK4H1348 
DTXSID00366537 
KRQFEURBUJROHA-UHFFFAOYSA-N 
ACT07851 
KS-000021WG 
ZINC2641165 
AR2447 
BBL010116 
3-(4-chlorophenyl)-1,2-oxazol-5-amine 
MFCD01569450 
SBB016692 
STK711173 
3-(4-Chlorophenyl)-5-aminoisoxazole 
3-(4-Chlorophenyl)isoxazole-5-amine 
5-Isoxazolamine,3-(4-chlorophenyl)- 
AKOS000117443 
AA-0845 
MCULE-3481450088 
RP11492 
3-(4-chlorophenyl)-5-isoxazolamine 
5-Isoxazolamine, 3-(4-chlorophenyl)- 
AJ-44084 
BP-20206 
SC-45832 
TR-014107 
5-Amino-3-(4-chlorophenyl)isoxazole, 97% 
BB 0218486 
CS-0085329 
FT-0680763 
ST24041464 
5-Amino-3-(4-chlorophenyl)isoxazole 
ST45255557 
Z2628 
EN300-09527 
3-(4-CHLOROPHENYL)-ISOXAZOL-5-YLAMINE 
C-1340 
A821969 
I05-1826 
J-510682 
F1984-0145 
C9H7ClN2O 
3-(4-Chloro-phenyl)-isoxazol-5-ylamine 
2-Hydroxymethylpyridin-3-ol 
ZINC02641165 
CID2104062 
5-Amino-3-(4-chlorophenyl)isoxazole, 97% - 1G 1g 
4369-55-5 
3-(4-chlorophenyl)isoxazole-5-ylamine 
PubChem15541 
ACMC-20ank8 
AC1M1RRJ 
Literature
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