octadecyl 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate

CAS: 66232-30-2

Molecular Formula	`C30H51Cl2NO2`
Molecular Weight	528.6 g/mol
LogP	11.8
Topological Polar Surface Area	29.5 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	25
Exact Mass	527.3297
Heavy Atoms	35
Complexity	463.0

Chemical Identifiers

CAS Number	66232-30-2
SMILES	`CCCCCCCCCCCCCCCCCCOC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl`
InChIKey	`XHDQZPFSXMCVDF-UHFFFAOYSA-N`

📖 Product Overview

octadecyl 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate (CAS: 66232-30-2) is a chemical compound with molecular formula C30H51Cl2NO2 and molecular weight 528.6 g/mol. Its IUPAC systematic name is octadecyl 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate. LogP 11.8 Topological Polar Surface Area 29.5 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 25 Exact Mass 527.3297 Heavy Atoms 35 Complexity 463.0 InChI Key: XHDQZPFSXMCVDF-UHFFFAOYSA-N. SMILES: CCCCCCCCCCCCCCCCCCOC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl.

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