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2-amino-4-(4-fluorophenyl)-4H-benzo[g]chromene-3-carbonitrile

HCID 178917588
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Basic information

CAS
861208-25-5
Standard SMILES
N#CC1=C(N)Oc2cc3ccccc3cc2C1c1ccc(F)cc1
InChIKey
MWYXXQPGVBHJGF-UHFFFAOYSA-N
Molecular formula
C20H13FN2O
Average molar mass
316.3 g/mol

Names & identifiers

Preferred name
2-amino-4-(4-fluorophenyl)-4H-benzo[g]chromene-3-carbonitrile
IUPAC
2-amino-4-(4-fluorophenyl)-4H-benzo[g]chromene-3-carbonitrile
English name
2-Amino-4-(4-fluorophenyl)-4H-benzo[g]chromene-3-carbonitrile
Molecular formula
C20H13FN2O
Molecular weight
316.33

Names & synonyms

2-amino-4-(4-fluorophenyl)-4H-benzo[g]chromene-3-carbonitrile861208-25-5MFCD06496159AKOS0050843411Y-0938SR-01000309051SR-01000309051-14H-Naphtho[2,3-b]pyran-3-carbonitrile, 2-amino-4-(4-fluorophenyl)-

Database identifiers

CAS
861208-25-5

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
59 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
24
Formal charge
0
Complexity
557

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

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