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128104-82-5 | 2-Naphthalenemethanol, 1-chloro-3,4-dihydro-
CAS No: 128104-82-5 Catalog No: AG000XT5 MDL No:MFCD12025871
Product Description
Catalog Number:
AG000XT5
Chemical Name:
2-Naphthalenemethanol, 1-chloro-3,4-dihydro-
CAS Number:
128104-82-5
Molecular Formula:
C11H11ClO
Molecular Weight:
194.6574
MDL Number:
MFCD12025871
IUPAC Name:
(1-chloro-3,4-dihydronaphthalen-2-yl)methanol
InChI:
InChI=1S/C11H11ClO/c12-11-9(7-13)6-5-8-3-1-2-4-10(8)11/h1-4,13H,5-7H2
InChI Key:
IFPWUATXSMOUFP-UHFFFAOYSA-N
SMILES:
OCC1=C(Cl)c2c(CC1)cccc2
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.05g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.658g/mol
Monoisotopic Mass:
194.05g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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