3-[bis(2-chloroethyl)amino]-5-methylbenzoic acid
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![3-[bis(2-chloroethyl)amino]-5-methylbenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/aefa6706577141f8886e78eab6c6175c.png "3-[bis(2-chloroethyl)amino]-5-methylbenzoic acid")
3-[bis(2-chloroethyl)amino]-5-methylbenzoic acid
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CAS No:
17191-65-0
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Formula:
C12H15Cl2NO2
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Chemical Name:
3-[bis(2-chloroethyl)amino]-5-methylbenzoic acid
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Synonyms:
17191-65-0;m-Toluic acid, 5-bis(2-chloroethyl)amino-;BRN 3097447;5-Bis(2-chloroethyl)amino-m-toluic acid;5-Bis(2-chloroethyl)amino-3-methylbenzoic acid;Benzoic acid, 5-bis(2-chloroethyl)amino-3-methyl-;Acidul 5,N,N-di-(2-cloretil)amino-3-metilbenzoic [Romanian];Acidul 5,N,N-di-(2-cloretil)amino-3-metilbenzoic;Benzoic acid, 3-[bis(2-chloroethyl)amino]-5-methyl-;DTXSID80169189;5-[Bis(2-chloroethyl)amino]-m-toluic acid
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CAS No:
3-[bis(2-chloroethyl)amino]-5-methylbenzoic acid Basic Attributes
276.16 g/mol
275.0479841 g/mol
DTXSID80169189
Computed Properties
Molecular Weight:276.16
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:275.0479841
Monoisotopic Mass:275.0479841
Topological Polar Surface Area:40.5
Heavy Atom Count:17
Complexity:245
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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