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Home > Bromides > 1949816-46-9
1949816-46-9 | 3-Allyl-5,7-dimethylbenzo[d]thiazol-2(3H)-imine hydrobromide
CAS No: 1949816-46-9 Catalog No: AG01FMZH MDL No:MFCD26940490
Product Description
Catalog Number:
AG01FMZH
Chemical Name:
3-Allyl-5,7-dimethylbenzo[d]thiazol-2(3H)-imine hydrobromide
CAS Number:
1949816-46-9
Molecular Formula:
C12H15BrN2S
Molecular Weight:
299.2299
MDL Number:
MFCD26940490
IUPAC Name:
5,7-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-imine;hydrobromide
InChI:
InChI=1S/C12H14N2S.BrH/c1-4-5-14-10-7-8(2)6-9(3)11(10)15-12(14)13;/h4,6-7,13H,1,5H2,2-3H3;1H
InChI Key:
BSQKLVVTBYKZKC-UHFFFAOYSA-N
SMILES:
C=CCn1c(=N)sc2c1cc(C)cc2C.Br
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.014g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
299.23g/mol
Monoisotopic Mass:
298.014g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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