Boc-Arg (NO2) -OH 10000mg

CAT: 0628-A23350-10000Size: 10000 mgDry Ice: NoHazardous: No

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CAT#:0628-A23350-10000Size:10000 mg

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CAS Number

2188-18-3

Chemical Information

L-Ornithine, N2-[(1,1-dimethylethoxy)carbonyl]-N5-[imino(nitroamino)methyl]-

CAS Number	2188-18-3
PubChem CID	75141
IUPAC Name	(2S)-5-[[amino(nitramido)methylidene]amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
Molecular Formula	C11H21N5O6
Molecular Weight	319.31
XLogP	0.3
Topological Polar Surface Area	172
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	9
Heavy Atom Count	22
Formal Charge	0
Complexity	439

SMILES

CC(C)(C)OC(=O)N[C@@H](CCCN=C(N)N[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H21N5O6/c1-11(2,3)22-10(19)14-7(8(17)18)5-4-6-13-9(12)15-16(20)21/h7H,4-6H2,1-3H3,(H,14,19)(H,17,18)(H3,12,13,15)/t7-/m0/s1

InChIKey

OZSSOVRIEPAIMP-ZETCQYMHSA-N

Chemical Structure

2D Structure

CAS: 2188-18-3

CID: 75141

Formula: C11H21N5O6

MW: 319.31

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	319.31
XLogP3	0.3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	9
Exact Mass	319.14918341
Monoisotopic Mass	319.14918341
Topological Polar Surface Area	172 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	439
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes