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175920-98-6 | 3-Allyl-6-methylbenzo[d]thiazol-2(3H)-imine hydrobromide
CAS No: 175920-98-6 Catalog No: AG01FMZV MDL No:MFCD00796256
Product Description
Catalog Number:
AG01FMZV
Chemical Name:
3-Allyl-6-methylbenzo[d]thiazol-2(3H)-imine hydrobromide
CAS Number:
175920-98-6
Molecular Formula:
C11H13BrN2S
Molecular Weight:
285.2033
MDL Number:
MFCD00796256
IUPAC Name:
6-methyl-3-prop-2-enyl-1,3-benzothiazol-2-imine;hydrobromide
InChI:
InChI=1S/C11H12N2S.BrH/c1-3-6-13-9-5-4-8(2)7-10(9)14-11(13)12;/h3-5,7,12H,1,6H2,2H3;1H
InChI Key:
WAFTUOHADUMPGZ-UHFFFAOYSA-N
SMILES:
C=CCn1c(=N)sc2c1ccc(c2)C.Br
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.998g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
285.203g/mol
Monoisotopic Mass:
283.998g/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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