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3-(5-nitrobenzotriazol-1-yl)propane-1,2-diol

3-(5-nitrobenzotriazol-1-yl)propane-1,2-diol structure

CAS No:
80479-67-0
Formula:
C9H10N4O4
Chemical Name:
3-(5-nitrobenzotriazol-1-yl)propane-1,2-diol
Synonyms:
3-(5-nitrobenzotriazol-1-yl)propane-1,2-diol;80479-67-0;NSC341055;DTXSID30319172;NSC-341055;DS-013858

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3-(5-nitrobenzotriazol-1-yl)propane-1,2-diol Basic Attributes

Molecular Weight：

238.20 g/mol

Exact Mass：

238.07020481 g/mol

NSC Number：

341055

DSSTox ID：

DTXSID30319172

Characteristics

PSA：

117 Å²

Computed Properties

Molecular Weight:238.20
XLogP3:-0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:238.07020481
Monoisotopic Mass:238.07020481
Topological Polar Surface Area:117
Heavy Atom Count:17
Complexity:285
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(5-nitrobenzotriazol-1-yl)propane-1,2-diol

Basic Attributes
Characteristics
Computed Properties

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