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Home > Bromides > 1178004-35-7
1178004-35-7 | 1-((S)-2-Bromomethyl-pyrrolidin-1-yl)-ethanone
CAS No: 1178004-35-7 Catalog No: AG01EQVS MDL No:
Product Description
Catalog Number:
AG01EQVS
Chemical Name:
1-((S)-2-Bromomethyl-pyrrolidin-1-yl)-ethanone
CAS Number:
1178004-35-7
Molecular Formula:
C7H12BrNO
Molecular Weight:
206.0803
IUPAC Name:
1-[(2S)-2-(bromomethyl)pyrrolidin-1-yl]ethanone
InChI:
InChI=1S/C7H12BrNO/c1-6(10)9-4-2-3-7(9)5-8/h7H,2-5H2,1H3/t7-/m0/s1
InChI Key:
VEORRLMAIMETPN-ZETCQYMHSA-N
SMILES:
BrC[C@@H]1CCCN1C(=O)C
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
205.01g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.083g/mol
Monoisotopic Mass:
205.01g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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