Home Halogens tert-butyl 2-(3-bromo-2-oxopyrrolidin-1-yl)acetate

tert-butyl 2-(3-bromo-2-oxopyrrolidin-1-yl)acetate

CAS No.:
178946-66-2
Catalog Number:
AG01B297
Molecular Formula:
C10H16BrNO3
Molecular Weight:
278.1429
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Product Description
Catalog Number:
AG01B297
Chemical Name:
tert-butyl 2-(3-bromo-2-oxopyrrolidin-1-yl)acetate
CAS Number:
178946-66-2
Molecular Formula:
C10H16BrNO3
Molecular Weight:
278.1429
MDL Number:
MFCD30342743
IUPAC Name:
tert-butyl 2-(3-bromo-2-oxopyrrolidin-1-yl)acetate
InChI:
InChI=1S/C10H16BrNO3/c1-10(2,3)15-8(13)6-12-5-4-7(11)9(12)14/h7H,4-6H2,1-3H3
InChI Key:
CCEDMIFCTNAVOT-UHFFFAOYSA-N
SMILES:
BrC1CCN(C1=O)CC(=O)OC(C)(C)C
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.031g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.146g/mol
Monoisotopic Mass:
277.031g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties