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1254300-95-2 | 2-BenzothiazolaMine, 7-Methoxy-
CAS No: 1254300-95-2 Catalog No: AG000NP2 MDL No:MFCD12911753
Product Description
Catalog Number:
AG000NP2
Chemical Name:
2-BenzothiazolaMine, 7-Methoxy-
CAS Number:
1254300-95-2
Molecular Formula:
C8H8N2OS
Molecular Weight:
180.2269
MDL Number:
MFCD12911753
IUPAC Name:
7-methoxy-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C8H8N2OS/c1-11-6-4-2-3-5-7(6)12-8(9)10-5/h2-4H,1H3,(H2,9,10)
InChI Key:
GXCUPRDHTOSKBC-UHFFFAOYSA-N
SMILES:
COc1cccc2c1sc(n2)N
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.036g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.225g/mol
Monoisotopic Mass:
180.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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