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1375301-87-3

1375301-87-3 | 1H-Imidazole-1-ethanamine, 4-bromo-

CAS No: 1375301-87-3 Catalog No: AG0013IN MDL No:MFCD22381847

Product Description

Catalog Number:
AG0013IN
Chemical Name:
1H-Imidazole-1-ethanamine, 4-bromo-
CAS Number:
1375301-87-3
Molecular Formula:
C5H8BrN3
Molecular Weight:
190.0411
MDL Number:
MFCD22381847
IUPAC Name:
2-(4-bromoimidazol-1-yl)ethanamine
InChI:
InChI=1S/C5H8BrN3/c6-5-3-9(2-1-7)4-8-5/h3-4H,1-2,7H2
InChI Key:
QWHKHPVXSFYHEZ-UHFFFAOYSA-N
SMILES:
NCCn1cnc(c1)Br

Properties

Complexity:
88.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.99g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.044g/mol
Monoisotopic Mass:
188.99g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0

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