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1609403-17-9 | 3-Pyridinemethanol, 5-bromo-α,α-dimethyl-, hydrochloride (1:1)
CAS No: 1609403-17-9 Catalog No: AG001VIV MDL No:MFCD28024784
Product Description
Catalog Number:
AG001VIV
Chemical Name:
3-Pyridinemethanol, 5-bromo-α,α-dimethyl-, hydrochloride (1:1)
CAS Number:
1609403-17-9
Molecular Formula:
C8H11BrClNO
Molecular Weight:
252.5360
MDL Number:
MFCD28024784
IUPAC Name:
2-(5-bromopyridin-3-yl)propan-2-ol;hydrochloride
InChI:
InChI=1S/C8H10BrNO.ClH/c1-8(2,11)6-3-7(9)5-10-4-6;/h3-5,11H,1-2H3;1H
InChI Key:
QMPSSJSPSDFTEM-UHFFFAOYSA-N
SMILES:
CC(c1cncc(c1)Br)(O)C.Cl
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.971g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
252.536g/mol
Monoisotopic Mass:
250.971g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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