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7-[4-(2-chloroethylsulfanylmethyl)phenyl]benzo[a]anthracene

7-[4-(2-chloroethylsulfanylmethyl)phenyl]benzo[a]anthracene structure

CAS No:
31236-11-0
Formula:
C27H21ClS
Chemical Name:
7-[4-(2-chloroethylsulfanylmethyl)phenyl]benzo[a]anthracene
Synonyms:
31236-11-0;2-chloroethyl 4-(tetraphen-7-yl)benzyl sulfide;NSC116084;DTXSID10297464;ZINC1705584;NSC-116084

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7-[4-(2-chloroethylsulfanylmethyl)phenyl]benzo[a]anthracene Basic Attributes

Molecular Weight：

413.0 g/mol

Exact Mass：

412.1052495 g/mol

NSC Number：

116084

DSSTox ID：

DTXSID10297464

Characteristics

PSA：

25.3 Å²

Computed Properties

Molecular Weight:413.0
XLogP3:8.3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:412.1052495
Monoisotopic Mass:412.1052495
Topological Polar Surface Area:25.3
Heavy Atom Count:29
Complexity:513
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-[4-(2-chloroethylsulfanylmethyl)phenyl]benzo[a]anthracene

Basic Attributes
Characteristics
Computed Properties

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