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709038-29-9 | Benzothiazole, 2-propoxymethyl- (5CI)
CAS No: 709038-29-9 Catalog No: AG00FJQN MDL No:
Product Description
Catalog Number:
AG00FJQN
Chemical Name:
Benzothiazole, 2-propoxymethyl- (5CI)
CAS Number:
709038-29-9
IUPAC Name:
2-(propoxymethyl)-1,3-benzothiazole
InChI:
InChI=1S/C11H13NOS/c1-2-7-13-8-11-12-9-5-3-4-6-10(9)14-11/h3-6H,2,7-8H2,1H3
InChI Key:
DDMIFSRQIMGBKC-UHFFFAOYSA-N
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.291g/mol
Monoisotopic Mass:
207.072g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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