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1783568-99-9 | 4-Benzoxazolamine, 2-chloro-
CAS No: 1783568-99-9 Catalog No: AG0025YF MDL No:
Product Description
Catalog Number:
AG0025YF
Chemical Name:
4-Benzoxazolamine, 2-chloro-
CAS Number:
1783568-99-9
Molecular Formula:
C7H5ClN2O
Molecular Weight:
168.5804
IUPAC Name:
2-chloro-1,3-benzoxazol-4-amine
InChI:
InChI=1S/C7H5ClN2O/c8-7-10-6-4(9)2-1-3-5(6)11-7/h1-3H,9H2
InChI Key:
QZKSCCRBMBGZJL-UHFFFAOYSA-N
SMILES:
Clc1oc2c(n1)c(N)ccc2
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.009g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.58g/mol
Monoisotopic Mass:
168.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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