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610311-52-9 | Isoxazole, 3-methyl-5-(1H-pyrrol-1-yl)- (9CI)
CAS No: 610311-52-9 Catalog No: AG00EZG5 MDL No:
Product Description
Catalog Number:
AG00EZG5
Chemical Name:
Isoxazole, 3-methyl-5-(1H-pyrrol-1-yl)- (9CI)
CAS Number:
610311-52-9
IUPAC Name:
3-methyl-5-pyrrol-1-yl-1,2-oxazole
InChI:
InChI=1S/C8H8N2O/c1-7-6-8(11-9-7)10-4-2-3-5-10/h2-6H,1H3
InChI Key:
WDIYXXRPSJZDCD-UHFFFAOYSA-N
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.064g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.165g/mol
Monoisotopic Mass:
148.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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