CAS No.: 2536-31-4 — Chlorflurenol-methyl (整形醇)

1. Primary Information

English name:	Chlorflurenol-methyl
CAS No.:	2536-31-4
Molecular formula:	C₁₅H₁₁ClO₃
Molecular weight:	274.70 g/mol
SMILES:	COC(=O)C1(C2=CC=CC=C2C3=C1C=C(C=C3)Cl)O
Structural class:
Other identifiers:	2-chloro-9-hydroxyfluorene-9-carboxylic acid methyl ester chloroflurenol-methyl methyl morphactin

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	1.2ml	100μg/ml in methylbenzene:acetone(9:1)	80	2-8℃	in stock	-
Kehua Intelligence	50mg	99%	432	2-8℃	in stock	-
Kehua Intelligence	1g	70%(HPLC)	66	2-8℃	in stock	-
Kehua Intelligence	5g	70%(HPLC)	249	2-8℃	in stock	-
Kehua Intelligence	25g	70%(HPLC)	704	2-8℃	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 30 32 0 1 0 0 0 0 0999 V2000 4.8767 0.1640 -0.1669 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.2843 -1.1321 -2.1418 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3358 -1.8934 1.3303 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5009 -3.2315 -0.5456 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -0.8416 -0.7577 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9095 -0.0240 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4483 0.1086 -0.4045 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5163 1.2349 0.1339 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9293 1.3163 0.1162 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2475 -0.3719 -0.4763 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8136 -0.0866 -0.5427 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3965 -2.1363 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 2.1555 0.5488 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7792 2.3381 0.5076 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2027 0.5563 -0.0582 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6692 0.9436 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8154 1.8075 0.4496 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 2.1438 0.3725 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4031 -3.0512 2.1688 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5362 -1.3410 -0.8707 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2131 -1.0115 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1817 3.1260 0.9423 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 3.2715 0.9094 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1813 -1.3745 -2.4282 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7443 0.8173 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5665 2.5249 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8426 2.9319 0.6729 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -3.5728 2.0182 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -2.7208 3.2093 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4409 -3.7165 1.9636 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 5 1 0 0 0 0 2 24 1 0 0 0 0 3 12 1 0 0 0 0 3 19 1 0 0 0 0 4 12 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 6 8 2 0 0 0 0 6 10 1 0 0 0 0 7 9 1 0 0 0 0 7 11 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 14 2 0 0 0 0 10 15 2 0 0 0 0 10 20 1 0 0 0 0 11 16 1 0 0 0 0 11 21 1 0 0 0 0 13 17 2 0 0 0 0 13 22 1 0 0 0 0 14 18 1 0 0 0 0 14 23 1 0 0 0 0 15 17 1 0 0 0 0 16 18 2 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

methyl 2-chloro-9-hydroxyfluorene-9-carboxylate

4.2 InChI

InChI=1S/C15H11ClO3/c1-19-14(17)15(18)12-5-3-2-4-10(12)11-7-6-9(16)8-13(11)15/h2-8,18H,1H3

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)