4-[[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonyl]amino]benzoic acid
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![4-[[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/686afe29df354a5aa7fe397c7f0b8610.png "4-[[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonyl]amino]benzoic acid")
4-[[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonyl]amino]benzoic acid
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CAS No:
148-78-7
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Formula:
C18H18Cl2N2O4
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Chemical Name:
4-[[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonyl]amino]benzoic acid
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Synonyms:
Benzoic acid,4-[[[4-[bis(2-chloroethyl)amino]phenoxy]carbonyl]amino]-;Carbanilic acid,p-carboxy-,N-[p-[bis(2-chloroethyl)amino]phenyl] ester;Phenol,p-[bis(2-chloroethyl)amino]-,p-carboxycarbanilate (ester);4-[[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonyl]amino]benzoic acid;IC 140;4-[N,N-Bis(2-chloroethyl)amino]phenyl-N-(p-carboxyphenyl)carbamate;N-[p-[Bis(2-chloroethyl)amino]phenyl] p-carboxycarbanilate;4-[N,N,-bis-(2-Chloroethyl)amino]phenyl-N-(p-carboxyphenyl)carbamate;NSC 130998
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CAS No:
4-[[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonyl]amino]benzoic acid Basic Attributes
397.252
397.25
130998
DTXSID80163864
Computed Properties
Molecular Weight:397.2
XLogP3:3.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:396.0643624
Monoisotopic Mass:396.0643624
Topological Polar Surface Area:78.9
Heavy Atom Count:26
Complexity:445
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-[[[4-[Bis(2-chloroethyl)amino]phenoxy]carbonyl]amino]benzoic acid
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