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1216545-76-4 | Benzenemethanamine, 2-(1-methylethoxy)-, hydrochloride (1:1)
CAS No: 1216545-76-4 Catalog No: AG0015HN MDL No:MFCD15042178
Product Description
Catalog Number:
AG0015HN
Chemical Name:
Benzenemethanamine, 2-(1-methylethoxy)-, hydrochloride (1:1)
CAS Number:
1216545-76-4
Molecular Formula:
C10H16ClNO
Molecular Weight:
201.6931
MDL Number:
MFCD15042178
IUPAC Name:
(2-propan-2-yloxyphenyl)methanamine;hydrochloride
InChI:
InChI=1S/C10H15NO.ClH/c1-8(2)12-10-6-4-3-5-9(10)7-11;/h3-6,8H,7,11H2,1-2H3;1H
InChI Key:
VZBADVXRIFIZLK-UHFFFAOYSA-N
SMILES:
NCc1ccccc1OC(C)C.Cl
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.092g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
201.694g/mol
Monoisotopic Mass:
201.092g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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