CAS
92142-32-0 Purity
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92142-32-0 Purity
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(3R,4R)-7-Methyl-3,4-dihydrobenzo[c]acridine-3,4-diol
CAS
92145-26-1
Catalog Number
ACM92145261
Category
Other Products
Molecular Weight
277.317 g/mol
Molecular Formula
C18H15NO2
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Specification
Synonyms
7-Methylbenz(c)acridine-3,4-dihydrodiol, CID56345, 7-Methylbenz(c)acridine 3,4-dihydrodiol, LS-24857, trans-3,4-Dihydro-3,4-dihydroxy-7-methylbenz(c)acridine, trans-3,4-Dihydroxy-3,4-dihydro-7-methylbenz(c)acridine, BENZ(c)ACRIDINE-3,4-DIOL, 3,4-DIHYDRO-7-METHYL-, trans-, 92145-26-1
IUPAC Name
(3R,4R)-7-methyl-3,4-dihydrobenzo[c]acridine-3,4-diol
Canonical SMILES
CC1=C2C=CC3=C(C2=NC4=CC=CC=C14)C=CC(C3O)O
InChI Key
FDRGZRMEGHZBID-SJLPKXTDSA-N
Boiling Point
544.2ºC at 760 mmHg
Flash Point
282.9ºC
Density
1.377g/cm³
Exact Mass
277.11000
H-Bond Acceptor
3
H-Bond Donor
2
What is the IUPAC name of the compound with PubChem CID 56345?
The IUPAC name of the compound with PubChem CID 56345 is (3R,4R)-7-methyl-3,4-dihydrobenzo[c]acridine-3,4-diol.
What is the molecular weight of the compound?
The molecular weight of the compound is 277.3 g/mol.
What is the InChIKey of the compound?
The InChIKey of the compound is FDRGZRMEGHZBID-SJLPKXTDSA-N.
What is the canonical SMILES representation of the compound?
The canonical SMILES representation of the compound is CC1=C2C=CC3=C(C2=NC4=CC=CC=C14)C=CC(C3O)O.
How many hydrogen bond donor counts does the compound have?
The compound has 2 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does the compound have?
The compound has 3 hydrogen bond acceptor counts.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 53.4 ?2.
How many heavy atoms does the compound have?
The compound has 21 heavy atoms.
Does the compound have any defined atom stereocenter counts?
Yes, the compound has 2 defined atom stereocenter counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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