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Home > Bromides > 1785612-33-0
1785612-33-0 | 2-(3-bromo-1-methyl-1H-pyrazol-5-yl)ethan-1-ol
CAS No: 1785612-33-0 Catalog No: AG01EMJH MDL No:MFCD31616120
Product Description
Catalog Number:
AG01EMJH
Chemical Name:
2-(3-bromo-1-methyl-1H-pyrazol-5-yl)ethan-1-ol
CAS Number:
1785612-33-0
Molecular Formula:
C6H9BrN2O
Molecular Weight:
205.0525
MDL Number:
MFCD31616120
IUPAC Name:
2-(5-bromo-2-methylpyrazol-3-yl)ethanol
InChI:
InChI=1S/C6H9BrN2O/c1-9-5(2-3-10)4-6(7)8-9/h4,10H,2-3H2,1H3
InChI Key:
XWNGWKOEEGJNPV-UHFFFAOYSA-N
SMILES:
Cn1nc(cc1CCO)Br
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.99g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.055g/mol
Monoisotopic Mass:
203.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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