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30409-55-3 | Thiophene, 3-bromo-4-(3,4-dihydro-1-naphthalenyl)-
CAS No: 30409-55-3 Catalog No: AG003019 MDL No:
Product Description
Catalog Number:
AG003019
Chemical Name:
Thiophene, 3-bromo-4-(3,4-dihydro-1-naphthalenyl)-
CAS Number:
30409-55-3
Molecular Formula:
C14H11BrS
Molecular Weight:
291.2061
IUPAC Name:
3-bromo-4-(3,4-dihydronaphthalen-1-yl)thiophene
InChI:
InChI=1S/C14H11BrS/c15-14-9-16-8-13(14)12-7-3-5-10-4-1-2-6-11(10)12/h1-2,4,6-9H,3,5H2
InChI Key:
JFEZAXWNRPLLEF-UHFFFAOYSA-N
SMILES:
Brc1cscc1C1=CCCc2c1cccc2
NSC Number:
149688
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.976g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.206g/mol
Monoisotopic Mass:
289.976g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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