Home Other Building Blocks 3-TERT-BUTYL-5-(CHLOROMETHYL)ISOXAZOLE

3-TERT-BUTYL-5-(CHLOROMETHYL)ISOXAZOLE

CAS No.:
69602-60-4
Catalog Number:
AG01DWLQ
Molecular Formula:
C8H12ClNO
Molecular Weight:
173.6400
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DWLQ
Chemical Name:
3-TERT-BUTYL-5-(CHLOROMETHYL)ISOXAZOLE
CAS Number:
69602-60-4
Molecular Formula:
C8H12ClNO
Molecular Weight:
173.6400
MDL Number:
MFCD13190089
IUPAC Name:
3-tert-butyl-5-(chloromethyl)-1,2-oxazole
InChI:
InChI=1S/C8H12ClNO/c1-8(2,3)7-4-6(5-9)11-10-7/h4H,5H2,1-3H3
InChI Key:
LINYIIJIYSUIET-UHFFFAOYSA-N
SMILES:
ClCc1onc(c1)C(C)(C)C
Properties
Complexity:
133  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.061g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.64g/mol
Monoisotopic Mass:
173.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties