3-[bis(2-chloroethyl)amino]-4-chlorobenzoic acid
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![3-[bis(2-chloroethyl)amino]-4-chlorobenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/34c759b05f984b17a62631beb4c88478.png "3-[bis(2-chloroethyl)amino]-4-chlorobenzoic acid")
3-[bis(2-chloroethyl)amino]-4-chlorobenzoic acid
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CAS No:
69884-97-5
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Formula:
C11H12Cl3NO2
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Chemical Name:
3-[bis(2-chloroethyl)amino]-4-chlorobenzoic acid
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Synonyms:
BENZOIC ACID, 3-(BIS(2-CHLOROETHYL)AMINO)-4-CHLORO-;3-(Bis(2-chloroethyl)amino)-4-chlorobenzoic acid;3-[bis(2-chloroethyl)amino]-4-chlorobenzoic acid;69884-97-5;BRN 2989534;DTXSID00220165
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CAS No:
3-[bis(2-chloroethyl)amino]-4-chlorobenzoic acid Basic Attributes
296.6 g/mol
294.993362 g/mol
DTXSID00220165
Computed Properties
Molecular Weight:296.6
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:294.993362
Monoisotopic Mass:294.993362
Topological Polar Surface Area:40.5
Heavy Atom Count:17
Complexity:247
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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