Structure

1-Bromonaphthalene

CAS
90-11-9
Catalog Number
ACM90119
Category
Aryl
Molecular Weight
207.07
Molecular Formula
C10H7Br

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Specification

IUPAC Name
1-bromonaphthalene
Canonical SMILES
C1=CC=C2C(=C1)C=CC=C2Br
InChI
InChI=1S/C10H7Br/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H
InChI Key
DLKQHBOKULLWDQ-UHFFFAOYSA-N
Boiling Point
282 °C
Melting Point
-2 °C
Appearance
Colorless to Light orange to Yellow clear liquid
Storage
Keep in dark place. Sealed in dry. Room temperature.
Complexity
133
Covalently-Bonded Unit Count
1
EC Number
201-965-2
Exact Mass
205.97311g/mol
Formal Charge
0
Hazard Statements
H302 : Harmful if swallowed.H319 : Causes serious eye irritation.
H-Bond Acceptor
0
H-Bond Donor
0
Heavy Atom Count
11
MDL Number
MFCD00003868
Monoisotopic Mass
205.97311g/mol
NSC Number
6551
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P270 : Do not eat, drink or smoke when using this product.P264 : Wash skin thoroughly after handling.P280 : Wear 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.P301 + P312 + P330 : IF SWALLOWED: Call a POISON CENTER/doctor if you feel unwell. Rinse mouth.
Refractive Index
1.66
RIDADR
UN 3082 9 / PGIII
Rotatable Bond Count
0
Signal Word
Warning
Solubility In Water
Slightly soluble
Symbol
GHS07
UNII
976Y53P08P
XLogP3
4.3
What is the molecular formula of 1-Bromonaphthalene?

The molecular formula of 1-Bromonaphthalene is C10H7Br.

What is the molecular weight of 1-Bromonaphthalene?

The molecular weight of 1-Bromonaphthalene is 207.07 g/mol.

What is the IUPAC name of 1-Bromonaphthalene?

The IUPAC name of 1-Bromonaphthalene is 1-bromonaphthalene.

What is the InChI of 1-Bromonaphthalene?

The InChI of 1-Bromonaphthalene is InChI=1S/C10H7Br/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H.

What is the InChIKey of 1-Bromonaphthalene?

The InChIKey of 1-Bromonaphthalene is DLKQHBOKULLWDQ-UHFFFAOYSA-N.

What is the canonical SMILES of 1-Bromonaphthalene?

The canonical SMILES of 1-Bromonaphthalene is C1=CC=C2C(=C1)C=CC=C2Br.

What is the CAS number of 1-Bromonaphthalene?

The CAS number of 1-Bromonaphthalene is 90-11-9.

What is the European Community (EC) Number of 1-Bromonaphthalene?

The European Community (EC) Number of 1-Bromonaphthalene is 201-965-2.

What is the UNII of 1-Bromonaphthalene?

The UNII of 1-Bromonaphthalene is 976Y53P08P.

Is 1-Bromonaphthalene a canonicalized compound?

Yes, 1-Bromonaphthalene is a canonicalized compound.

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