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13895-08-4

13895-08-4 | 2-Benzoxazolamine, 6-methoxy-

CAS No: 13895-08-4 Catalog No: AG0019X3 MDL No:MFCD16036404

Product Description

Catalog Number:
AG0019X3
Chemical Name:
2-Benzoxazolamine, 6-methoxy-
CAS Number:
13895-08-4
Molecular Formula:
C8H8N2O2
Molecular Weight:
164.1613
MDL Number:
MFCD16036404
IUPAC Name:
6-methoxy-1,3-benzoxazol-2-amine
InChI:
InChI=1S/C8H8N2O2/c1-11-5-2-3-6-7(4-5)12-8(9)10-6/h2-4H,1H3,(H2,9,10)
InChI Key:
WQMHWUZZUTWZSC-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)oc(n2)N

Properties

Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.059g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.164g/mol
Monoisotopic Mass:
164.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
61.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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