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885267-00-5 | 1-(Azetidin-1-yl);-2-bromoethanone
CAS No: 885267-00-5 Catalog No: AG0048FA MDL No:MFCD08706308
Product Description
Catalog Number:
AG0048FA
Chemical Name:
1-(Azetidin-1-yl);-2-bromoethanone
CAS Number:
885267-00-5
Molecular Formula:
C5H8BrNO
Molecular Weight:
178.0271
MDL Number:
MFCD08706308
IUPAC Name:
1-(azetidin-1-yl)-2-bromoethanone
InChI:
InChI=1S/C5H8BrNO/c6-4-5(8)7-2-1-3-7/h1-4H2
InChI Key:
BWFNEFMRNYTXQG-UHFFFAOYSA-N
SMILES:
BrCC(=O)N1CCC1
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.979g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.029g/mol
Monoisotopic Mass:
176.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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