CAS No.: 2894-51-1 — 2-Amino-4'-chlorobenzophenone (2-氨基-4'-氯二苯甲酮)

1. Primary Information

English name:	2-Amino-4'-chlorobenzophenone
CAS No.:	2894-51-1
Molecular formula:	C₁₃H₁₀ClNO
Molecular weight:	231.68 g/mol
SMILES:	C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)Cl)N
Structural class:
Other identifiers:	-

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	10g	大于98%，化学纯	216	RT	in stock	-
Kehua Intelligence	25g	大于98%，化学纯	432	RT	in stock	-
Kehua Intelligence	100g	大于98%，化学纯	1640	RT	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 26 27 0 0 0 0 0 0 0999 V2000 -5.1019 -1.3063 -0.2138 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4416 2.3464 0.4902 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6769 0.6404 -2.1785 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5718 0.3140 0.2391 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0025 0.5320 0.1847 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3192 1.1253 0.3128 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1883 0.1079 -0.9739 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0621 -0.2018 1.4188 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -0.8421 -0.0151 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1386 1.3377 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3562 -0.6538 -1.0109 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2301 -0.9635 1.3818 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8772 -1.1894 0.1671 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4019 -1.4107 -0.1386 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4064 0.7691 0.1377 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 -0.6051 -0.0622 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -0.0289 2.3675 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2772 -1.5057 -0.0811 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0635 2.4107 0.4159 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8706 -0.8380 -1.9507 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6358 -1.3806 2.2989 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7866 -1.7825 0.1384 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4898 -2.4830 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2830 1.4089 0.1993 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1608 0.4664 -3.0496 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8355 1.2004 -2.1794 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 6 2 0 0 0 0 3 7 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 8 2 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 5 10 1 0 0 0 0 7 11 2 0 0 0 0 8 12 1 0 0 0 0 8 17 1 0 0 0 0 9 14 1 0 0 0 0 9 18 1 0 0 0 0 10 15 2 0 0 0 0 10 19 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 14 16 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

(2-aminophenyl)-(4-chlorophenyl)methanone

4.2 InChI

InChI=1S/C13H10ClNO/c14-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)15/h1-8H,15H2

4.3 InChIKey

APHLSUBLNQBFTM-UHFFFAOYSA-N

4.4 Canonical SMILES

C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)Cl)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)