5-[bis(2-chloroethyl)amino]-2-methylbenzoic acid
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![5-[bis(2-chloroethyl)amino]-2-methylbenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a0a29bcf3af8475f87530edf8bd254f6.png "5-[bis(2-chloroethyl)amino]-2-methylbenzoic acid")
5-[bis(2-chloroethyl)amino]-2-methylbenzoic acid
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CAS No:
5977-36-6
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Formula:
C12H15Cl2NO2
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Chemical Name:
5-[bis(2-chloroethyl)amino]-2-methylbenzoic acid
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Synonyms:
o-Toluic acid, 5-bis(2-chloroethyl)amino-;5977-36-6;BRN 3119531;5-Bis(2-chloroethyl)amino-o-toluic acid;5-Bis(2-chloroethyl)amino-2-methylbenzoic acid;Benzoic acid, 5-bis(2-chloroethyl)amino-2-methyl-;Acidul 5,N,N-di-(2-cloretil)amino-2-metilbenzoic [Romanian];Acidul 5,N,N-di-(2-cloretil)amino-2-metilbenzoic;Benzoic acid, 5-[bis(2-chloroethyl)amino]-2-methyl-;DTXSID80208502;5-[Bis(2-chloroethyl)amino]-o-toluic acid
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CAS No:
5-[bis(2-chloroethyl)amino]-2-methylbenzoic acid Basic Attributes
276.16 g/mol
275.0479841 g/mol
DTXSID80208502
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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