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613-53-6 | 2-(Tribromomethyl);quinoline
CAS No: 613-53-6 Catalog No: AG003NRF MDL No:MFCD00006755
Product Description
Catalog Number:
AG003NRF
Chemical Name:
2-(Tribromomethyl);quinoline
CAS Number:
613-53-6
Molecular Formula:
C10H6Br3N
Molecular Weight:
379.8733
MDL Number:
MFCD00006755
IUPAC Name:
2-(tribromomethyl)quinoline
InChI:
InChI=1S/C10H6Br3N/c11-10(12,13)9-6-5-7-3-1-2-4-8(7)14-9/h1-6H
InChI Key:
UDYYQHILRSDDMP-UHFFFAOYSA-N
SMILES:
BrC(c1ccc2c(n1)cccc2)(Br)Br
EC Number:
210-347-1
NSC Number:
610
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.803g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
379.877g/mol
Monoisotopic Mass:
376.805g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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