857-95-4
2-AMINO-3-[4-[4-[BIS(2-CHLOROETHYL)AMINO]PHENOXY]PHENYL]PROPANOIC ACID
Name
2-AMINO-3-[4-[4-[BIS(2-CHLOROETHYL)AMINO]PHENOXY]PHENYL]PROPANOIC ACID
pro_formula
C19 H22 Cl2 N2 O3
pro_molWeight
397.3
1Identification
【Name】
2-AMINO-3-[4-[4-[BIS(2-CHLOROETHYL)AMINO]PHENOXY]PHENYL]PROPANOIC ACID
【CAS】
【MDL】
MFCD01674288
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C19 H22 Cl2 N2 O3
【pro_molWeight】
397.3
【Inchi】
InChI=1S/C19H22Cl2N2O3/c20-9-11-23(12-10-21)15-3-7-17(8-4-15)26-16-5-1-14(2-6-16)13-18(22)19(24)25/h1-8,18H,9-13,22H2,(H,24,25)
【InChIKey】
InChIKey=IDJLCKJFVNGXOP-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1CC(C(=O)O)N)Oc2ccc(cc2)N(CCCl)CCCl
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:5
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2-AMINO-3-[4-[4-[BIS(2-CHLOROETHYL)AMINO]PHENOXY]PHENYL]PROPANOIC ACID.cml
quick_release
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