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Mc-Val-Cit-PAB-Cl
[CAS# 1639351-92-0]

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Identification
Name Mc-Val-Cit-PAB-Cl
Synonyms N-[(2S)-1-[[(2S)-5-(carbamoylamino)-1-[4-(chloromethyl)anilino]-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-6-(2,5-dioxopyrrol-1-yl)hexanamide
Molecular Structure CAS # 1639351-92-0, Mc-Val-Cit-PAB-Cl, N-[(2S)-1-[[(2S)-5-(carbamoylamino)-1-[4-(chloromethyl)anilino]-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-6-(2,5-dioxopyrrol-1-yl)hexanamide
Molecular Formula C28H39ClN6O6
Molecular Weight 591.10
CAS Registry Number 1639351-92-0
SMILES CC(C)[C@@H](C(=O)N[C@@H](CCCNC(=O)N)C(=O)NC1=CC=C(C=C1)CCl)NC(=O)CCCCCN2C(=O)C=CC2=O
Properties
Density 1.3±0.1 g/cm3, Calc.*
Index of Refraction 1.580, Calc.*
Boiling Point 915.4±65.0 ºC (760 mmHg), Calc.*
Flash Point 507.4±34.3 ºC, Calc.*
* Calculated using Advanced Chemistry Development (ACD/Labs) Software.
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