CAS No.: 9011-18-1 — Benzocaine (硫酸葡聚糖)

1. Primary Information

English name:	Benzocaine
CAS No.:	9011-18-1
Molecular formula:	C₉H₁₁NO₂
Molecular weight:	165.19 g/mol
SMILES:	CCOC(=O)C1=CC=C(C=C1)N
Structural class:
Other identifiers:	4-Aminobenzoic Acid Ethyl Ester Acetate, Benzocaine Americaine Anaesthesin Anesthesin

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	10g	超纯，分子量50万，98%	160	RT	in stock	-
Kehua Intelligence	50g	超纯，分子量50万，98%	520	RT	in stock	-
Kehua Intelligence	250g	超纯，分子量50万，98%	2400	RT	in stock	-
Kehua Intelligence	25g	AR，分子量5万，98%	1200	RT	in stock	-
Kehua Intelligence	100g	AR，分子量5万，98%	4000	RT	in stock	-
Kehua Intelligence	25g	AR，分子量4万，98%	520	RT	in stock	-
Kehua Intelligence	100g	AR，分子量4万，98%	1760	RT	in stock	-
Kehua Intelligence	500g	AR，分子量4万，98%	5280	RT	in stock	-
Kehua Intelligence	25g	AR，分子量2万，98%	520	RT	in stock	-
Kehua Intelligence	100g	AR，分子量2万，98%	1760	RT	in stock	-
Kehua Intelligence	5g	AR，分子量5000，98%	198	RT	in stock	-
Kehua Intelligence	25g	AR，分子量5000，98%	400	RT	in stock	-
Kehua Intelligence	100g	AR，分子量5000，98%	1440	RT	in stock	-
Kehua Intelligence	500g	AR，分子量5000，98%	6800	RT	in stock	-
Kehua Intelligence	5g	AR，分子量3000，98%	198	RT	in stock	-
Kehua Intelligence	25g	AR，分子量3000，98%	520	RT	in stock	-
Kehua Intelligence	100g	AR，分子量3000，98%	1760	RT	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 23 23 0 0 0 0 0 0 0999 V2000 -2.1131 -0.3568 0.0005 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7062 1.9089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1634 -0.7318 -0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1082 0.3619 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 1.3466 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4669 -0.9861 0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8017 -0.3646 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4427 0.9834 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8137 -1.3494 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2959 0.7406 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5238 -0.1131 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2535 -1.4395 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8381 2.4025 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2676 -1.7866 0.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2033 1.7599 -0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0812 -2.4031 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7946 0.4601 0.8926 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7929 0.4592 -0.8954 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3367 -1.2901 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9769 -2.0312 -0.8798 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9785 -2.0303 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4242 -1.7089 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 -0.0182 -0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 10 2 0 0 0 0 3 7 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 5 8 1 0 0 0 0 5 13 1 0 0 0 0 6 9 2 0 0 0 0 6 14 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 15 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 18 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

ethyl 4-aminobenzoate

4.2 InChI

InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3

4.3 InChIKey

BLFLLBZGZJTVJG-UHFFFAOYSA-N

4.4 Canonical SMILES

CCOC(=O)C1=CC=C(C=C1)N

4.5 Isomeric SMILES

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)

5.3 Mass spectrometry (MS)

Coming soon

5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon

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)