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54152-48-6 | 4,5-dimethyl-1,2,3,6-tetrahydropyridine
CAS No: 54152-48-6 Catalog No: AG01BHFT MDL No:MFCD19217753
Product Description
Catalog Number:
AG01BHFT
Chemical Name:
4,5-dimethyl-1,2,3,6-tetrahydropyridine
CAS Number:
54152-48-6
Molecular Formula:
C7H13N
Molecular Weight:
111.1848
MDL Number:
MFCD19217753
IUPAC Name:
4,5-dimethyl-1,2,3,6-tetrahydropyridine
InChI:
InChI=1S/C7H13N/c1-6-3-4-8-5-7(6)2/h8H,3-5H2,1-2H3
InChI Key:
VRKGEWIQYFKDEJ-UHFFFAOYSA-N
SMILES:
CC1=C(C)CCNC1
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.105g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
111.188g/mol
Monoisotopic Mass:
111.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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