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6234-01-1 | L-GlutaMic acid 5-tert-butyl 1-Methyl ester hydrochloride
CAS No: 6234-01-1 Catalog No: AG00353F MDL No:MFCD00153438
Product Description
Catalog Number:
AG00353F
Chemical Name:
L-GlutaMic acid 5-tert-butyl 1-Methyl ester hydrochloride
CAS Number:
6234-01-1
Molecular Formula:
C10H20ClNO4
Molecular Weight:
253.7231
MDL Number:
MFCD00153438
IUPAC Name:
5-O-tert-butyl 1-O-methyl (2S)-2-aminopentanedioate;hydrochloride
InChI:
InChI=1S/C10H19NO4.ClH/c1-10(2,3)15-8(12)6-5-7(11)9(13)14-4;/h7H,5-6,11H2,1-4H3;1H/t7-;/m0./s1
InChI Key:
YIFPACFSZQWAQF-FJXQXJEOSA-N
SMILES:
COC(=O)[C@H](CCC(=O)OC(C)(C)C)N.Cl
EC Number:
228-348-0
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
253.108g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
253.723g/mol
Monoisotopic Mass:
253.108g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
78.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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