Structure

1-Aminoanthracene

CAS
610-49-1
Catalog Number
ACM610491
Category
Amines
Molecular Weight
193.25
Molecular Formula
C14H11N

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Specification

Synonyms
1-Anthramine
IUPAC Name
anthracen-1-amine
Canonical SMILES
C1=CC=C2C=C3C(=CC2=C1)C=CC=C3N
InChI
InChI=1S/C14H11N/c15-14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)14/h1-9H,15H2
InChI Key
YUENFNPLGJCNRB-UHFFFAOYSA-N
Melting Point
121 °C
Density
Light Sensitive
Appearance
Light yellow to Brown to Dark green powder to crystal
Complexity
225
Covalently-Bonded Unit Count
1
EC Number
210-225-8
Exact Mass
193.089149g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
H-Bond Acceptor
1
H-Bond Donor
1
Heavy Atom Count
15
LogP
3.69 (LogP)
MDL Number
MFCD00003579
Monoisotopic Mass
193.089149g/mol
NSC Number
60017
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
RIDADR
NONH for all modes of transport
Rotatable Bond Count
0
Signal Word
Warning
Symbol
GHS06
UNII
8H6056DWN2
XLogP3
3.7
What is the molecular formula of 1-Aminoanthracene?

The molecular formula of 1-Aminoanthracene is C14H11N.

What is the molecular weight of 1-Aminoanthracene?

The molecular weight of 1-Aminoanthracene is 193.24 g/mol.

What is the IUPAC name of 1-Aminoanthracene?

The IUPAC name of 1-Aminoanthracene is anthracen-1-amine.

What is the InChI of 1-Aminoanthracene?

The InChI of 1-Aminoanthracene is InChI=1S/C14H11N/c15-14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)14/h1-9H,15H2.

What is the InChIKey of 1-Aminoanthracene?

The InChIKey of 1-Aminoanthracene is YUENFNPLGJCNRB-UHFFFAOYSA-N.

What is the canonical SMILES of 1-Aminoanthracene?

The canonical SMILES of 1-Aminoanthracene is C1=CC=C2C=C3C(=CC2=C1)C=CC=C3N.

What is the CAS number of 1-Aminoanthracene?

The CAS number of 1-Aminoanthracene is 610-49-1.

What is the PubChem CID of 1-Aminoanthracene?

The PubChem CID of 1-Aminoanthracene is 11885.

What is the XLogP3 value of 1-Aminoanthracene?

The XLogP3 value of 1-Aminoanthracene is 3.7.

What is the topological polar surface area of 1-Aminoanthracene?

The topological polar surface area of 1-Aminoanthracene is 26Ų.

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