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34582-30-4 | (S)-1-tert-Butyl 4-methyl 2-aminosuccinate hydrochloride
CAS No: 34582-30-4 Catalog No: AG003A41 MDL No:MFCD05662354
Product Description
Catalog Number:
AG003A41
Chemical Name:
(S)-1-tert-Butyl 4-methyl 2-aminosuccinate hydrochloride
CAS Number:
34582-30-4
Molecular Formula:
C9H18ClNO4
Molecular Weight:
239.6965
MDL Number:
MFCD05662354
IUPAC Name:
1-O-tert-butyl 4-O-methyl (2S)-2-aminobutanedioate;hydrochloride
InChI:
InChI=1S/C9H17NO4.ClH/c1-9(2,3)14-8(12)6(10)5-7(11)13-4;/h6H,5,10H2,1-4H3;1H/t6-;/m0./s1
InChI Key:
FGBVDHWVRGDHRV-RGMNGODLSA-N
SMILES:
COC(=O)C[C@@H](C(=O)OC(C)(C)C)N.Cl
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
239.092g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.696g/mol
Monoisotopic Mass:
239.092g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
78.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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