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N,N-bis(2-chloroethyl)-4-isothiocyanatoaniline

N,N-bis(2-chloroethyl)-4-isothiocyanatoaniline structure

CAS No:
17614-68-5
Formula:
C11H12Cl2N2S
Chemical Name:
N,N-bis(2-chloroethyl)-4-isothiocyanatoaniline
Synonyms:
NSC240416;17614-68-5;DTXSID60311205;Isothiocyanic acid, p-[bis(2-chloroethyl)amino]phenyl ester;ZINC1763030;NSC-240416;N,N-Bis(2-chloroethyl)-p-isothiocyanatophenylamine;Benzenamine,N-bis(2-chloroethyl)-4-isothiocyanato-

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N,N-bis(2-chloroethyl)-4-isothiocyanatoaniline Basic Attributes

Molecular Weight：

275.2 g/mol

Exact Mass：

274.0098250 g/mol

NSC Number：

240416

DSSTox ID：

DTXSID60311205

Characteristics

PSA：

47.7 Å²

Computed Properties

Molecular Weight:275.2
XLogP3:5.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:274.0098250
Monoisotopic Mass:274.0098250
Topological Polar Surface Area:47.7
Heavy Atom Count:16
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N,N-bis(2-chloroethyl)-4-isothiocyanatoaniline

Basic Attributes
Characteristics
Computed Properties

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