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29449-90-9 | 2-Pyridinamine, 6-bromo-N-(3-methoxypropyl)-
CAS No: 29449-90-9 Catalog No: AG002YE5 MDL No:MFCD12026037
Product Description
Catalog Number:
AG002YE5
Chemical Name:
2-Pyridinamine, 6-bromo-N-(3-methoxypropyl)-
CAS Number:
29449-90-9
Molecular Formula:
C9H13BrN2O
Molecular Weight:
245.1163
MDL Number:
MFCD12026037
IUPAC Name:
6-bromo-N-(3-methoxypropyl)pyridin-2-amine
InChI:
InChI=1S/C9H13BrN2O/c1-13-7-3-6-11-9-5-2-4-8(10)12-9/h2,4-5H,3,6-7H2,1H3,(H,11,12)
InChI Key:
UDZRXVMMKXMTRE-UHFFFAOYSA-N
SMILES:
COCCCNc1cccc(n1)Br
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.021g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.12g/mol
Monoisotopic Mass:
244.021g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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