CAS No.: 25451-15-4 — Felbamate (Felbamate (W-554))

1. Primary Information

English name:	Felbamate
CAS No.:	25451-15-4
Molecular formula:	C₁₁H₁₄N₂O₄
Molecular weight:	238.24 g/mol
SMILES:	C1=CC=C(C=C1)C(COC(=O)N)COC(=O)N
Structural class:
Other identifiers:	(3-Carbamoyloxy-2-phenyl-propyl) carbamate 2 Phenyl 1,3 propanediol dicarbamate 2-phenyl-1,3-propanediol dicarbamate ADD 03055 ADD-03055

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	5mg	98%	224	RT，避光	in stock	-
Kehua Intelligence	10mg	98%	400	RT，避光	in stock	-
Kehua Intelligence	50mg	98%	760	RT，避光	in stock	-
Kehua Intelligence	100mg	98%	1120	RT，避光	in stock	-
Kehua Intelligence	1g	98%	4240	RT，避光	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 31 31 0 0 0 0 0 0 0999 V2000 -2.3963 0.7925 0.5031 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4463 0.7845 0.3996 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7613 2.1738 -0.7331 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7441 2.1661 -0.9066 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6264 0.7282 0.8318 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6899 0.7274 0.6173 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0149 0.6391 0.3735 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0065 -0.8613 0.1069 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2538 1.3181 -0.1637 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2704 1.3051 -0.2113 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6021 -1.3234 -1.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5702 -1.7088 1.0293 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -2.6967 -1.2914 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5504 -3.0821 0.7856 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0458 -3.5760 -0.3748 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6043 1.3096 0.1229 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6323 1.3039 -0.0417 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0227 0.7696 1.4652 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1951 2.3883 0.0768 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3636 1.2493 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2298 2.3859 -0.0288 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3215 1.1348 -1.2943 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0337 -0.6800 -1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0368 -1.3337 1.9351 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0795 -3.0815 -2.1983 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9997 -3.7668 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0597 -4.6451 -0.5652 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4457 0.0156 1.5308 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5935 0.9929 0.6781 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 0.0162 1.3263 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6475 0.9943 0.4152 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 16 1 0 0 0 0 2 10 1 0 0 0 0 2 17 1 0 0 0 0 3 16 2 0 0 0 0 4 17 2 0 0 0 0 5 16 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 17 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 18 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 12 14 2 0 0 0 0 12 24 1 0 0 0 0 13 15 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

(3-carbamoyloxy-2-phenylpropyl) carbamate

4.2 InChI

InChI=1S/C11H14N2O4/c12-10(14)16-6-9(7-17-11(13)15)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H2,12,14)(H2,13,15)

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)