CAS No.: 68641-49-6 — Bis(2-oxo-3-oxazolidinyl)phosphinic chloride (双(2-氧代-3-恶唑烷基)次磷酰氯)

1. Primary Information

English name:	Bis(2-oxo-3-oxazolidinyl)phosphinic chloride
CAS No.:	68641-49-6
Molecular formula:	C₆H₈ClN₂O₅P
Molecular weight:	254.56 g/mol
SMILES:	C1COC(=O)N1P(=O)(N2CCOC2=O)Cl
Structural class:
Other identifiers:	bis(2-oxo-3-oxazolidinyl)phosphinic chloride BOP-Cl

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	5g	BR，97%	64	RT	in stock	-
Kehua Intelligence	25g	BR，97%	288	RT	in stock	-
Kehua Intelligence	100g	BR，97%	1120	RT	in stock	-
Kehua Intelligence	500g	BR，97%	5120	RT	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 23 24 0 0 0 0 0 0 0999 V2000 0.1140 2.8614 0.7795 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0019 1.3071 -0.4872 P 0 0 0 0 0 0 0 0 0 0 0 0 2.7147 -1.0836 0.9334 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7305 -1.4330 -0.1434 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0558 1.8179 -1.8985 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9622 -0.1442 2.0652 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9744 -1.4005 -1.6095 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 0.2562 -0.2078 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 0.3157 -0.0642 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3507 -0.0666 -1.1329 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3548 0.6372 0.8613 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0608 -1.2070 -0.4531 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0742 -0.6754 1.0249 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5891 -0.3028 1.0265 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5998 -0.8823 -0.6943 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9975 0.8107 -1.2329 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9437 -0.3368 -2.1102 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9957 1.3957 0.4012 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9549 1.0132 1.8057 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 -2.1819 -0.8069 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1462 -1.1543 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7284 -1.2291 1.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1589 -0.5506 1.0867 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 5 2 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 3 12 1 0 0 0 0 3 14 1 0 0 0 0 4 13 1 0 0 0 0 4 15 1 0 0 0 0 6 14 2 0 0 0 0 7 15 2 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 11 19 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

3-[chloro-(2-oxo-1,3-oxazolidin-3-yl)phosphoryl]-1,3-oxazolidin-2-one

4.2 InChI

InChI=1S/C6H8ClN2O5P/c7-15(12,8-1-3-13-5(8)10)9-2-4-14-6(9)11/h1-4H2

4.3 InChIKey

KLDLRDSRCMJKGM-UHFFFAOYSA-N

4.4 Canonical SMILES

C1COC(=O)N1P(=O)(N2CCOC2=O)Cl

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)