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101931-30-0

101931-30-0 | 1-Naphthalenemethanamine, 4-(1-methylethoxy)-, hydrobromide (1:1)

CAS No: 101931-30-0 Catalog No: AG0005Z0 MDL No:

Product Description

Catalog Number:
AG0005Z0
Chemical Name:
1-Naphthalenemethanamine, 4-(1-methylethoxy)-, hydrobromide (1:1)
CAS Number:
101931-30-0
Molecular Formula:
C14H18BrNO
Molecular Weight:
296.2028
IUPAC Name:
(4-propan-2-yloxynaphthalen-1-yl)methylazanium;bromide
InChI:
InChI=1S/C14H17NO.BrH/c1-10(2)16-14-8-7-11(9-15)12-5-3-4-6-13(12)14;/h3-8,10H,9,15H2,1-2H3;1H
InChI Key:
XBHFEZLJGBMCTR-UHFFFAOYSA-N
SMILES:
NCc1ccc(c2c1cccc2)OC(C)C.Br

Properties

Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.057g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.208g/mol
Monoisotopic Mass:
295.057g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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