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87831-16-1 | Butanoic acid, 2-azido-4-bromo-, 2-(trimethylsilyl)ethyl ester
CAS No: 87831-16-1 Catalog No: AG004JNK MDL No:
Product Description
Catalog Number:
AG004JNK
Chemical Name:
Butanoic acid, 2-azido-4-bromo-, 2-(trimethylsilyl)ethyl ester
CAS Number:
87831-16-1
Molecular Formula:
C9H18BrN3O2Si
Molecular Weight:
308.2476
IUPAC Name:
2-trimethylsilylethyl 2-azido-4-bromobutanoate
InChI:
InChI=1S/C9H18BrN3O2Si/c1-16(2,3)7-6-15-9(14)8(4-5-10)12-13-11/h8H,4-7H2,1-3H3
InChI Key:
WIZURMAGOVWDNZ-UHFFFAOYSA-N
SMILES:
BrCCC(C(=O)OCC[Si](C)(C)C)N=[N+]=[N-]
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.035g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.251g/mol
Monoisotopic Mass:
307.035g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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