Molecular properties
- Formula
- C13H18Cl2N2O2
- Molar mass
- 305.20 g·mol−1
- Exact mass
- 304.0745 Da
- 5
- PubChem CID
- 460612
Molecule record
(2S)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid
C13H18Cl2N2O2
305.20 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Alkyl halide
Aromatic ring
Carboxylic acid
Primary amine
Tertiary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 148-82-3
- 4-[Bis(2-chloroethyl)amino]-L-phenylalanine
- Alanine Nitrogen Mustard
- CB 3025
- L-PAM
- L-Phenylalanine mustard
- L-Sarcolysin
- L-Sarcolysine
Show all 24 synonyms
- L-Sarkolysin
- Levofalan
- Levofolan
- Levopholan
- Melfalan
- Melfalano
- Melphalanum
- NCI-C04853
- NSC-8806
- Phenylalanine mustard
- Phenylalanine nitrogen mustard
- SK-15673
- melphalan
- p-Bis(beta-chloroethyl)aminophenylalanine
- p-Di-(2-chloroethyl)amino-L-phenylalanine
- p-L-Sarcolysin
Structure identifiers
- Canonical SMILES
- N[C@@H](Cc1ccc(N(CCCl)CCCl)cc1)C(=O)O
- Isomeric SMILES
- C1=CC(=CC=C1C[C@@H](C(=O)O)N)N(CCCl)CCCl
- InChI
- InChI=1S/C13H18Cl2N2O2/c14-5-7-17(8-6-15)11-3-1-10(2-4-11)9-12(16)13(18)19/h1-4,12H,5-9,16H2,(H,18,19)/t12-/m0/s1
- InChIKey
- SGDBTWWWUNNDEQ-LBPRGKRZSA-N
- PubChem CID
- 460612
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for (2S)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for (2S)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.