Home Other Building Blocks 2-(1,3-benzoxazol-2-yl)ethan-1-amine dihydrochloride

2-(1,3-benzoxazol-2-yl)ethan-1-amine dihydrochloride

CAS No.:
1803606-67-8
Catalog Number:
AG01BBNN
Molecular Formula:
C9H12Cl2N2O
Molecular Weight:
235.1104
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Product Description
Catalog Number:
AG01BBNN
Chemical Name:
2-(1,3-benzoxazol-2-yl)ethan-1-amine dihydrochloride
CAS Number:
1803606-67-8
Molecular Formula:
C9H12Cl2N2O
Molecular Weight:
235.1104
MDL Number:
MFCD28506066
IUPAC Name:
2-(1,3-benzoxazol-2-yl)ethanamine;dihydrochloride
InChI:
InChI=1S/C9H10N2O.2ClH/c10-6-5-9-11-7-3-1-2-4-8(7)12-9;;/h1-4H,5-6,10H2;2*1H
InChI Key:
PNFURSXNEDZWPD-UHFFFAOYSA-N
SMILES:
NCCc1nc2c(o1)cccc2.Cl.Cl
Properties
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.033g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
235.108g/mol
Monoisotopic Mass:
234.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties