CAS No.: 575-36-0 — 1-Acetamidonaphthalene (N-乙酰-1-萘胺)

1. Primary Information

English name:	1-Acetamidonaphthalene
CAS No.:	575-36-0
Molecular formula:	C₁₂H₁₁NO
Molecular weight:	185.22 g/mol
SMILES:	CC(=O)NC1=CC=CC2=CC=CC=C21
Structural class:
Other identifiers:	-

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	100mg	99%	496	RT	in stock	-
Kehua Intelligence	5g	98%	182	RT	in stock	-
Kehua Intelligence	25g	98%	624	RT	in stock	-
Kehua Intelligence	100g	98%	1960	RT	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 25 26 0 0 0 0 0 0 0999 V2000 3.5991 -0.6697 -0.0023 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6998 0.7253 0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 0.2605 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7477 -0.6975 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6288 -0.1763 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0296 1.6271 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -2.0641 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -1.5381 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0824 -0.2606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0923 -2.4802 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3613 2.0432 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3857 1.1012 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0679 0.4361 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9012 1.6931 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2829 2.4143 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2085 -2.8180 0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9261 -1.9578 0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8993 -0.9793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1425 -3.5408 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4718 1.7131 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 3.1030 -0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4222 1.4258 -0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6932 2.2752 -0.9013 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9633 1.4335 0.0189 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6684 2.2930 0.8853 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 5 1 0 0 0 0 2 13 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 2 0 0 0 0 4 7 1 0 0 0 0 4 9 2 0 0 0 0 5 8 2 0 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 7 10 2 0 0 0 0 7 16 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 9 12 1 0 0 0 0 9 18 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

N-naphthalen-1-ylacetamide

4.2 InChI

InChI=1S/C12H11NO/c1-9(14)13-12-8-4-6-10-5-2-3-7-11(10)12/h2-8H,1H3,(H,13,14)

4.3 InChIKey

OKQIEBVRUGLWOR-UHFFFAOYSA-N

4.4 Canonical SMILES

CC(=O)NC1=CC=CC2=CC=CC=C21

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)