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86604-74-2 | 2-(Chloromethyl)-4-methoxy-3-methylpyridine hydrochloride
CAS No: 86604-74-2 Catalog No: AG004U0S MDL No:MFCD03425333
Product Description
Catalog Number:
AG004U0S
Chemical Name:
2-(Chloromethyl)-4-methoxy-3-methylpyridine hydrochloride
CAS Number:
86604-74-2
Molecular Formula:
C8H11Cl2NO
Molecular Weight:
208.0850
MDL Number:
MFCD03425333
IUPAC Name:
2-(chloromethyl)-4-methoxy-3-methylpyridine;hydrochloride
InChI:
InChI=1S/C8H10ClNO.ClH/c1-6-7(5-9)10-4-3-8(6)11-2;/h3-4H,5H2,1-2H3;1H
InChI Key:
WHAGSNVVBXOIGQ-UHFFFAOYSA-N
SMILES:
COc1ccnc(c1C)CCl.Cl
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.022g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.082g/mol
Monoisotopic Mass:
207.022g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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