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Home > Bromides > 1820711-91-8
1820711-91-8 | 8-Bromo-5-methoxy-1,2,3,4-tetrahydro-1,6-naphthyridine
CAS No: 1820711-91-8 Catalog No: AG01FMQC MDL No:MFCD28369849
Product Description
Catalog Number:
AG01FMQC
Chemical Name:
8-Bromo-5-methoxy-1,2,3,4-tetrahydro-1,6-naphthyridine
CAS Number:
1820711-91-8
Molecular Formula:
C9H11BrN2O
Molecular Weight:
243.1004
MDL Number:
MFCD28369849
IUPAC Name:
8-bromo-5-methoxy-1,2,3,4-tetrahydro-1,6-naphthyridine
InChI:
InChI=1S/C9H11BrN2O/c1-13-9-6-3-2-4-11-8(6)7(10)5-12-9/h5,11H,2-4H2,1H3
InChI Key:
YEOCLMGLLJUOMF-UHFFFAOYSA-N
SMILES:
COc1ncc(c2c1CCCN2)Br
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.005g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.104g/mol
Monoisotopic Mass:
242.005g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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