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methyl (2S)-5-carbamimidamido-2-acetamidopentanoate hydrochloride

methyl (2S)-5-carbamimidamido-2-acetamidopentanoate hydrochloride

CAS: 1784-05-0

Formula: C9H19ClN4O3

SMILES: Cl.COC(=O)[C@H](CCCNC(N)=N)NC(C)=O

IUPAC: methyl (2S)-5-carbamimidamido-2-acetamidopentanoate hydrochloride

InChI: InChI=1S/C9H18N4O3.ClH/c1-6(14)13-7(8(15)16-2)4-3-5-12-9(10)11;/h7H,3-5H2,1-2H3,(H,13,14)(H4,10,11,12);1H/t7-;/m0./s1

Composition: C (40.53%), H (7.18%), Cl (13.29%), N (21.01%), O (17.99%)

Molar Mass: 266.73

Atom Count: 36

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 266.1145682
Formal Charge 0
FSP3 0.67
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 4
InChIKey FIUSXBMWQFBXLZ-FJXQXJEOSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.14
Topological Polar Surface Area 117.3
Polarizability 22.39
Ring Count 0
Rotatable Bond Count 7

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99% <7 Days 1784-05-0 $272.21-$473.00$272.21$473.00
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