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1003872-58-9 | Tricyclo[3.3.1.13,7]decane-1-carboxylic acid, 4-amino-, methyl ester, hydrochloride (1:1), stereoisomer
CAS No: 1003872-58-9 Catalog No: AG0001UI MDL No:MFCD18071515
Product Description
Catalog Number:
AG0001UI
Chemical Name:
Tricyclo[3.3.1.13,7]decane-1-carboxylic acid, 4-amino-, methyl ester, hydrochloride (1:1), stereoisomer
CAS Number:
1003872-58-9
MDL Number:
MFCD18071515
IUPAC Name:
methyl (3S)-4-aminoadamantane-1-carboxylate;hydrochloride
InChI:
InChI=1S/C12H19NO2.ClH/c1-15-11(14)12-4-7-2-8(5-12)10(13)9(3-7)6-12;/h7-10H,2-6,13H2,1H3;1H/t7?,8-,9?,10?,12?;/m0./s1
InChI Key:
MANHEPNXZVTZLG-DXFGONOJSA-N
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
245.118g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
245.747g/mol
Monoisotopic Mass:
245.118g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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