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Structure

3,4-Dinitrobenzyl alcohol

CAS
79544-31-3
Catalog Number
ACM79544313
Category
Other Products
Molecular Weight
198.13
Molecular Formula
C7H6N2O5

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Specification

Synonyms
3,4-Dinitrobenzyl alcohol, Benzenemethanol, 3,4-dinitro-, EINECS 279-178-9, CID157302, ZINC06091872, 79544-31-3
IUPAC Name
(3,4-dinitrophenyl)methanol
Canonical SMILES
C1=CC(=C(C=C1CO)[N+](=O)[O-])[N+](=O)[O-]
InChI Key
GALBVKDHQBDIJR-UHFFFAOYSA-N
Boiling Point
433.1ºC at 760 mmHg
Flash Point
197.1ºC
Density
1.56g/cm³
EC Number
279-178-9
Exact Mass
198.02800
H-Bond Acceptor
5
H-Bond Donor
1
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