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90642-84-5 | 4-(Pyridin-4-yl);butan-1-ol hydrochloride
CAS No: 90642-84-5 Catalog No: AG003K50 MDL No:MFCD09836644
Product Description
Catalog Number:
AG003K50
Chemical Name:
4-(Pyridin-4-yl);butan-1-ol hydrochloride
CAS Number:
90642-84-5
Molecular Formula:
C9H14ClNO
Molecular Weight:
187.6666
MDL Number:
MFCD09836644
IUPAC Name:
4-pyridin-4-ylbutan-1-ol;hydrochloride
InChI:
InChI=1S/C9H13NO.ClH/c11-8-2-1-3-9-4-6-10-7-5-9;/h4-7,11H,1-3,8H2;1H
InChI Key:
SKKZAWIISKPYSI-UHFFFAOYSA-N
SMILES:
OCCCCc1ccncc1.Cl
Properties
Complexity:
89.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.076g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
187.667g/mol
Monoisotopic Mass:
187.076g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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