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Nω−モノメチル−L−セリンアセテート分子構造

Nω−モノメチル−L−セリンアセテート分子構造

Nω−モノメチル−L−セリンアセテート

: IUPAC名称：(2S)-2-amino-5-[(N'-methylcarbamimidoyl)amino]pentanoic acid; CAS登録番号: 17035-90-4; 分子：188.23

見積りを送ります

1. 名前と識別子

: 1.1 商品名; Nω−モノメチル−L−セリンアセテート; 1.2 シノニム; (2S)-2-amino-5-[(N'-methylcarbamimidoyl)amino]pentanoic acid (S)-2-Amino-5-(3-methylguanidino)pentanoic acid H-Arg(Me)-OH Acetate salt L-NMMA L-NMMA, Tilarginine, Targinine L-Ornithine, N-[imino(methylamino)methyl]-, acetate (1:1) MONOMETHYL-L-ARGININE N-(N-Methylcarbamimidoyl)-L-ornithine acetate (1:1) N(omega)-methyl-L-arginine NG-Methylarginine acetate NG-monomethyl-L-argine NG-Monomethyl-L-arginine NW-METHYL-L-ARGININE ACETATE Nω-Monomethyl-L-arginine Acetate omega-n-methylarginine targinina Targinine targininum tilarginina Tilarginine Tilarginine acetate tilargininum Tocris-0771; すべてを表示

1.3 CAS登録番号: 17035-90-4

1.4 CID: 132862

1.5 分子式: C7H16N4O2 (isomer)

1.6 Inchi: InChI=1S/C7H16N4O2/c1-10-7(9)11-4-2-3-5(8)6(12)13/h5H,2-4,8H2,1H3,(H,12,13)(H3,9,10,11)/t5-/m0/s1

1.7 InchiKey: NTNWOCRCBQPEKQ-YFKPBYRVSA-N

1.8 標準的な SMILES: CNC(=N)NCCC[C@H](N)C(O)=O

1.9 異性体 SMILES: CN=C(N)NCCC[C@@H](C(=O)O)N

2. 性質

2.1 密度: 1.32±0.1 g/cm3(Predicted)

2.2 沸騰点: 341.0±52.0 °C(Predicted)

2.3 よび点: 191.3°C

2.4 PSA: 148.53000

2.5 logP: 0.59500

2.6 pKa: 2.50±0.24(Predicted)

3. MSDS情報

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s)	no data available
Signal word	no data available
Hazard statement(s)	no data available
Precautionary statement(s)
Prevention	no data available
Response	no data available
Storage	no data available
Disposal	no data available

2.3 Other hazards which do not result in classification

no data available

すべてを表示

4. 計算化学データ

分子: 188.23g/mol
分子式: C₇H₁₆N₄O₂
Compound Is Canonicalized: True
XLogP3-AA: null
Exact Mass: 188.12732577
Monoisotopic Mass: 188.12732577
Complexity: 193
Rotatable Bond Count: 6
Hydrogen Bond Donor Count: 4
Hydrogen Bond Acceptor Count: 4
Topological Polar Surface Area: 114
Heavy Atom Count: 13
Defined Atom Stereocenter Count: 1
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADceBjsAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHgAQCAAACCjBgAQDCALAAgAoAACQLAAAAAEAAAABAIGIAACCABIAiAAEQAAEEAIAAACYEQIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

5. 推奨ベンダー

Global6しいれ業者すべてを表示 >>

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Time: 2021/01/14

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Price:
Time: 2019/11/25

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CarboMer, Inc.

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Nw-Methyl-L-arginine acetate

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6. 実際の製品情報

NG-MONOMETHYL-L-ARGININE ACETATE

53308-83-1 NG-MONOMETHYL-L-ARGININE ACETATE

NALPHA,NOMEGA-DICARBOBENZOXY-L-ARGININE

53934-75-1 NALPHA,NOMEGA-DICARBOBENZOXY-L-ARGININE

L-MONOMETHYL-L-ARGININE

2480-28-6 L-MONOMETHYL-L-ARGININE

NG-MONOMETHYL-D-ARGININE MONOACETATE

137694-75-8 NG-MONOMETHYL-D-ARGININE MONOACETATE

L-Arginine acetate

71173-62-1 L-Arginine acetate

Monomethyl adipate

627-91-8 Monomethyl adipate

Monomethyl fumarate

2756-87-8 Monomethyl fumarate

最近の更新 : 1787294-52-3 1564933-37-4 1566228-39-4 1567052-39-4 474558-55-9 1565743-82-9 1594871-98-3 2903520-96-5 1565577-46-9 1564881-39-5

ディレクトリ

1. 名前と識別子

: 1.1 商品名; 1.2 シノニム; 1.3 CAS登録番号; 1.4 CID; 1.5 分子式; 1.6 Inchi; 1.7 InchiKey; 1.8 標準的な SMILES; 1.9 異性体 SMILES

2. 性質

: 2.1 密度; 2.2 沸騰点; 2.3 よび点; 2.4 PSA; 2.5 logP; 2.6 pKa

4.計算化学データ

5.推奨ベンダー