148-82-3
Product Name:
Melphalan
Formula:
C13H18Cl2N2O2
Synonyms:
L -PAM;L -Phenylalanine mustard;4-[Bis(2-chloroethyl)amino]-L -phenylalanine
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Melphalan appears as white to buff-colored powder. Odorless or with a faint odor. An antineoplastic medicine. |
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Color/Form | Needles from methanol (monosolvate) |
Odor | Odorless |
Melting Point | 351 °F (decomposes) (NTP, 1992) |
Solubility | less than 1 mg/mL at 72 °F (NTP, 1992) |
LogP | -0.52 |
Stability/Shelf Life | Stable under recommended storage conditions. |
Optical Rotation | Specific optical rotation: -31.5 deg at 22 °C/D (c = 0.67 in methanol); +7.5 deg 25 °C/D (c = 1.33 in 1.0 N HCl) |
Decomposition | Hazardous decomposition products formed under fire conditions - Carbon oxides, nitrogen oxides (NOx), hydrogen chloride gas. |
Collision Cross Section | 168.7 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards] |
Other Experimental Properties | Needles from methanol (monosolvate), MP: 1815.-182 °C (decomposes). Specific optical rotation: -7.5 deg at 21 °C/D (c = 1.26 in 1.0 N HCl) /Melphalan D-form/ |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Skull and Crossbones Acute Toxicity GHS06 Health Hazard GHS08 |
GHS Hazard Statements |
H300:Acute toxicity,oral H317:Sensitisation, Skin H340:Germ cell mutagenicity H350:Carcinogenicity H361:Reproductive toxicity |
Precautionary Statement Codes |
P201:Obtain special instructions before use. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. |
COMPUTED DESCRIPTORS
Molecular Weight | 305.20 g/mol |
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XLogP3 | -0.5 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 8 |
Exact Mass | 304.0745332 g/mol |
Monoisotopic Mass | 304.0745332 g/mol |
Topological Polar Surface Area | 66.6 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 265 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 1 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Melphalan appears as white to buff-colored powder. Odorless or with a faint odor. An antineoplastic medicine.