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NSC49756

NSC49756 structure

CAS No:
7248-71-7
Formula:
C9H8BrNO3S
Chemical Name:
NSC49756
Synonyms:
NSC49756;2-(2-bromoethyl)-1,1-dioxo-1,2-benzothiazol-3-one;1,2-Benzisothiazol-3(2H)-one, 2-(2-bromoethyl)-, 1,1-dioxide;2-(2-Bromoethyl)-1,2-benzothiazol-3(2h)-one 1,1-dioxide

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NSC49756 Basic Attributes

Molecular Weight：

290.13

Exact Mass：

288.94083 g/mol

NSC Number：

49756

DSSTox ID：

DTXSID90287227

HScode：

2934100090

Characteristics

PSA：

62.83000

XLogP3：

2.24470

Density：

1.775±0.06 g/cm3

Melting Point：

95-96 °C

Boiling Point：

433.3±47.0 °C(Predicted)

Flash Point：

215.9ºC

Refractive Index：

1.643

PKA：

-15.14±0.20

Computed Properties

Molecular Weight:290.14
XLogP3:1.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:288.94083
Monoisotopic Mass:288.94083
Topological Polar Surface Area:62.8
Heavy Atom Count:15
Complexity:362
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 3-methylbutanal; sodium hydrochloride; methyl alcohol structure; cyanic acid; methanol molecular weight; ammonium sulfide formula

Guide of NSC49756

Basic Attributes
Characteristics
Computed Properties

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