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1332528-62-7 | 3-pyrrolidin-2-ylisoxazole hydrochloride
CAS No: 1332528-62-7 Catalog No: AG00JDN6 MDL No:MFCD18064616
Product Description
Catalog Number:
AG00JDN6
Chemical Name:
3-pyrrolidin-2-ylisoxazole hydrochloride
CAS Number:
1332528-62-7
Molecular Formula:
C7H10N2O
Molecular Weight:
138.1671
MDL Number:
MFCD18064616
IUPAC Name:
3-pyrrolidin-2-yl-1,2-oxazole;hydrochloride
InChI:
InChI=1S/C7H10N2O.ClH/c1-2-6(8-4-1)7-3-5-10-9-7;/h3,5-6,8H,1-2,4H2;1H
InChI Key:
JEYXPTZFPMHYOJ-UHFFFAOYSA-N
SMILES:
C1CNC(C1)c1nocc1
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.056g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
174.628g/mol
Monoisotopic Mass:
174.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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