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157642-10-9 | Methanone, (5-bromo-2-furanyl)-1-pyrrolidinyl-
CAS No: 157642-10-9 Catalog No: AG001PL2 MDL No:MFCD00460935
Product Description
Catalog Number:
AG001PL2
Chemical Name:
Methanone, (5-bromo-2-furanyl)-1-pyrrolidinyl-
CAS Number:
157642-10-9
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
MDL Number:
MFCD00460935
IUPAC Name:
(5-bromofuran-2-yl)-pyrrolidin-1-ylmethanone
InChI:
InChI=1S/C9H10BrNO2/c10-8-4-3-7(13-8)9(12)11-5-1-2-6-11/h3-4H,1-2,5-6H2
InChI Key:
CHXUGJXTWLFHHF-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(o1)Br)N1CCCC1
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.989g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.088g/mol
Monoisotopic Mass:
242.989g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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