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1784-04-9 | L-Arginine, N2-benzoyl-, methyl ester, hydrochloride (1:1)
CAS No: 1784-04-9 Catalog No: AG0025ZP MDL No:MFCD00038945
Product Description
Catalog Number:
AG0025ZP
Chemical Name:
L-Arginine, N2-benzoyl-, methyl ester, hydrochloride (1:1)
CAS Number:
1784-04-9
Molecular Formula:
C14H21ClN4O3
Molecular Weight:
328.7945
MDL Number:
MFCD00038945
IUPAC Name:
methyl (2S)-2-benzamido-5-(diaminomethylideneamino)pentanoate;hydrochloride
InChI:
InChI=1S/C14H20N4O3.ClH/c1-21-13(20)11(8-5-9-17-14(15)16)18-12(19)10-6-3-2-4-7-10;/h2-4,6-7,11H,5,8-9H2,1H3,(H,18,19)(H4,15,16,17);1H/t11-;/m0./s1
InChI Key:
MMZBVARFMVSTCT-MERQFXBCSA-N
SMILES:
COC(=O)[C@@H](NC(=O)c1ccccc1)CCCNC(=N)N.Cl
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
328.13g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
328.797g/mol
Monoisotopic Mass:
328.13g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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