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1220039-63-3

1220039-63-3 | 4-Pyridineethanol, β-amino-, hydrochloride (1:2)

CAS No: 1220039-63-3 Catalog No: AG0016KY MDL No:MFCD15474985

Product Description

Catalog Number:
AG0016KY
Chemical Name:
4-Pyridineethanol, β-amino-, hydrochloride (1:2)
CAS Number:
1220039-63-3
Molecular Formula:
C7H12Cl2N2O
Molecular Weight:
211.0890
MDL Number:
MFCD15474985
IUPAC Name:
2-amino-2-pyridin-4-ylethanol;dihydrochloride
InChI:
InChI=1S/C7H10N2O.2ClH/c8-7(5-10)6-1-3-9-4-2-6;;/h1-4,7,10H,5,8H2;2*1H
InChI Key:
XLAMHJAZOJEAEP-UHFFFAOYSA-N
SMILES:
OCC(c1ccncc1)N.Cl.Cl

Properties

Complexity:
91.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.033g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
211.086g/mol
Monoisotopic Mass:
210.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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