CAS No.: 32289-58-0 — N'-[6-[(N'-methylcarbamimidoyl)amino]hexyl]ethanimidamide (聚六亚甲基双胍盐酸盐)

1. Primary Information

English name:	N'-[6-[(N'-methylcarbamimidoyl)amino]hexyl]ethanimidamide
CAS No.:	32289-58-0
Molecular formula:	C₁₀H₂₃N₅
Molecular weight:	213.32 g/mol
SMILES:	CC(=NCCCCCCNC(=NC)N)N
Structural class:
Other identifiers:	-

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	100mg	97%	960	2-8℃ 氮气保存	in stock	-
Kehua Intelligence	5g	95%	64	2-8℃ 氮气保存	in stock	-
Kehua Intelligence	25g	95%	144	2-8℃ 氮气保存	in stock	-
Kehua Intelligence	100g	95%	400	2-8℃ 氮气保存	in stock	-
Kehua Intelligence	25g	20% in water	40	2-8℃ 氮气保存	in stock	-
Kehua Intelligence	100g	20% in water	100	2-8℃ 氮气保存	in stock	-
Kehua Intelligence	500g	20% in water	360	2-8℃ 氮气保存	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 38 37 0 0 0 0 0 0 0999 V2000 3.7786 -0.6794 -0.0301 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 0.6712 -0.0154 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9446 -1.3860 0.0069 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4615 0.9614 0.0369 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2129 0.7965 0.0062 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1368 0.3723 -0.0475 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1727 -0.4175 -0.0171 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -0.5598 -0.0491 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3848 0.5135 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6557 0.2277 -0.0397 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6896 -0.2701 0.0192 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1072 -0.2896 0.0069 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9934 0.1600 0.0151 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0588 -1.3511 0.0827 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8888 1.2511 0.0741 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1632 1.0084 -0.9406 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1835 1.0364 0.8242 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2113 -1.0993 -0.8755 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2054 -1.0356 0.8884 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3143 -1.2102 -0.9323 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3097 -1.2179 0.8283 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3648 1.1183 -0.9644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3355 1.2167 0.7919 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7093 0.8706 -0.9257 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6947 0.8709 0.8468 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6797 -0.8445 0.9526 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7067 -0.9482 -0.8415 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5719 -1.6742 -0.0569 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5951 -1.7347 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1053 -1.6763 0.1129 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6233 -1.8122 -0.8076 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9539 -1.2947 0.0315 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5731 -2.3295 -0.0179 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2688 1.8086 -0.0327 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0905 0.2888 0.0376 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3987 0.8728 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3583 0.8418 0.9746 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0304 2.3361 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 1 28 1 0 0 0 0 2 11 1 0 0 0 0 2 13 2 0 0 0 0 3 12 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 12 2 0 0 0 0 4 15 1 0 0 0 0 5 13 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 13 14 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

N'-[6-[(N'-methylcarbamimidoyl)amino]hexyl]ethanimidamide

4.2 InChI

InChI=1S/C10H23N5/c1-9(11)14-7-5-3-4-6-8-15-10(12)13-2/h3-8H2,1-2H3,(H2,11,14)(H3,12,13,15)

1. Primary Information

2. Suppliers & Pricing

3. Structures

3.1 2D structure

3.2 3D structure

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4.2 InChI

4.3 InChIKey

4.4 Canonical SMILES

4.5 Isomeric SMILES

4.6 SDF file

5. Spectroscopic data

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)

5.3 Mass spectrometry (MS)

5.4 Infrared spectroscopy (IR)

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

1. Primary Information

2. Suppliers & Pricing

3. Structures

3.1 2D structure

3.2 3D structure

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4.2 InChI

4.3 InChIKey

4.4 Canonical SMILES

4.5 Isomeric SMILES

4.6 SDF file

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

5.4 Infrared spectroscopy (IR)

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)