Home Halogens 3-bromo-N-(2-butoxyethyl)aniline

3-bromo-N-(2-butoxyethyl)aniline

CAS No.:
1247147-26-7
Catalog Number:
AG01AJGK
Molecular Formula:
C12H18BrNO
Molecular Weight:
272.1814
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Product Description
Catalog Number:
AG01AJGK
Chemical Name:
3-bromo-N-(2-butoxyethyl)aniline
CAS Number:
1247147-26-7
Molecular Formula:
C12H18BrNO
Molecular Weight:
272.1814
MDL Number:
MFCD14677253
IUPAC Name:
3-bromo-N-(2-butoxyethyl)aniline
InChI:
InChI=1S/C12H18BrNO/c1-2-3-8-15-9-7-14-12-6-4-5-11(13)10-12/h4-6,10,14H,2-3,7-9H2,1H3
InChI Key:
ZGWNBYQDKMFESH-UHFFFAOYSA-N
SMILES:
CCCCOCCNc1cccc(c1)Br
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.057g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
272.186g/mol
Monoisotopic Mass:
271.057g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties