HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

7-Chloro-1,8-naphthyridin-2-amine

HCID 85199
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
15944-33-9
Standard SMILES
Nc1ccc2ccc(Cl)nc2n1
InChIKey
HRXBYPUUCBEZAS-UHFFFAOYSA-N
Molecular formula
C8H6ClN3
Average molar mass
179.6 g/mol
Monoisotopic mass
179.0250249

Names & identifiers

Preferred name
7-Chloro-1,8-naphthyridin-2-amine
IUPAC
7-chloro-1,8-naphthyridin-2-amine
English name
7-chloro-1,8-naphthyridin-2-amine
Molecular formula
C8H6ClN3
Molecular weight
179.61

Names & synonyms

7-Chloro-1,8-naphthyridin-2-amine15944-33-92-Amino-7-chloro-1,8-naphthyridineEINECS 240-078-5DTXSID10166661RefChem:546011DTXCID9089152240-078-5MFCD118785741,8-Naphthyridin-2-amine, 7-chloro-SCHEMBL64123432-amino-7chloro-1,8-naphthyridine
Show more names
2-amino-7-chloro-1, 8-naphthidine1,8-Naphthyridin-2-amine,7-chloro-2-chloro-7-amino-1,8-naphthyridine
QAA944332-amino-7-chloro-1,8-napthyridine2-chloro-7-amino-1,8-napthyridineAKOS006343105DA-35743PS-11579SY128196CS-0215919

Database identifiers

CAS
15944-33-9
PubChem CID
85199
DTXSID
DTXSID10166661
EC Number
240-078-5
Nikkaji
J219.907F

Properties

Computed structural propertiesFilling in

XLogP
2.1
Topological polar surface area
51.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
12
Formal charge
0
Complexity
164

Physicochemical properties

Melting point
179 · 179-182 °C(Solv: acetone (67-64-1))
Boiling point
351.2 · 351.2±37.0 °C(Predicted)
Density
1.445 · 1.445±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C, protect from light
form
powder
pka
4.21 · 4.21±0.30(Predicted)
color
Yellow
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
HS Code
2933998090 · 2933998090

Safety & regulation

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

GHS classification

GHS Classification · 5 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%);Acute Tox. 4 (50%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);Acute Tox. 4 (50%);STOT SE 3 (100%)

Safety data

hs_code
2933998090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501

Chemistry & industry

Upstream & downstream products

Downstream products

Pazinaclone

Related reactions

89 records
New reaction record
HRID 908 reaction equation
HRID 908As reactantuspto-grants-1998_03
HRID 145453 reaction equation
HRID 145453As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 145659 reaction equation
HRID 145659As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 159581 reaction equation
HRID 159581As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 192458 reaction equation
HRID 192458As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 198221 reaction equation
HRID 198221As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 235804 reaction equation
HRID 235804As reactantuspto-grants-1987_02
HRID 235805 reaction equation
HRID 235805As reactantuspto-grants-1987_02
Page 1 of 12

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes