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1005010-02-5 | 2-Pyridinamine, 5-bromo-N-(2-methoxyethyl)-
CAS No: 1005010-02-5 Catalog No: AG00025Z MDL No:MFCD11123673
Product Description
Catalog Number:
AG00025Z
Chemical Name:
2-Pyridinamine, 5-bromo-N-(2-methoxyethyl)-
CAS Number:
1005010-02-5
Molecular Formula:
C8H11BrN2O
Molecular Weight:
231.0897
MDL Number:
MFCD11123673
IUPAC Name:
5-bromo-N-(2-methoxyethyl)pyridin-2-amine
InChI:
InChI=1S/C8H11BrN2O/c1-12-5-4-10-8-3-2-7(9)6-11-8/h2-3,6H,4-5H2,1H3,(H,10,11)
InChI Key:
YECPICKDQOYKMY-UHFFFAOYSA-N
SMILES:
COCCNc1ccc(cn1)Br
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.005g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.093g/mol
Monoisotopic Mass:
230.005g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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