Home Aminos 1,2-Benzenediol, 4-[(ethylamino)methyl]-, hydrobromide (1:1)

1,2-Benzenediol, 4-[(ethylamino)methyl]-, hydrobromide (1:1)

CAS No.:
1456821-60-5
Catalog Number:
AG001DA9
Molecular Formula:
C9H14BrNO2
Molecular Weight:
248.1170
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Product Description
Catalog Number:
AG001DA9
Chemical Name:
1,2-Benzenediol, 4-[(ethylamino)methyl]-, hydrobromide (1:1)
CAS Number:
1456821-60-5
Molecular Formula:
C9H14BrNO2
Molecular Weight:
248.1170
MDL Number:
MFCD26383906
IUPAC Name:
4-(ethylaminomethyl)benzene-1,2-diol;hydrobromide
InChI:
InChI=1S/C9H13NO2.BrH/c1-2-10-6-7-3-4-8(11)9(12)5-7;/h3-5,10-12H,2,6H2,1H3;1H
InChI Key:
BAIVRLRNJROSFF-UHFFFAOYSA-N
SMILES:
CCNCc1ccc(c(c1)O)O.Br
Properties
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.021g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
248.12g/mol
Monoisotopic Mass:
247.021g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties