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53899-17-5 | 8-METHOXY-1,2,3,4-TETRAHYDROQUINOLINE
CAS No: 53899-17-5 Catalog No: AG00DHX4 MDL No:MFCD07800307
Product Description
Catalog Number:
AG00DHX4
Chemical Name:
8-METHOXY-1,2,3,4-TETRAHYDROQUINOLINE
CAS Number:
53899-17-5
Molecular Formula:
C10H13NO
Molecular Weight:
163.2163
MDL Number:
MFCD07800307
IUPAC Name:
8-methoxy-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C10H13NO/c1-12-9-6-2-4-8-5-3-7-11-10(8)9/h2,4,6,11H,3,5,7H2,1H3
InChI Key:
ZPRWUIXDTQZKJO-UHFFFAOYSA-N
SMILES:
COc1cccc2c1NCCC2
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.1g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.22g/mol
Monoisotopic Mass:
163.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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