CAS 3731-53-1 4-Pyridinemethanamine (HCID 77317)

Overview

structure given in first source

Names & identifiers

Preferred name: 4-Pyridinemethanamine
IUPAC: pyridin-4-ylmethanamine
English name: 4-Pyridinemethaneamine
Molecular formula: C6H8N2
Molecular weight: 108.14

Names & synonyms

3731-53-14-(Aminomethyl)pyridine4-Pyridinemethanamine4-PyridylmethylaminePyridine, 4-(aminomethyl)-NSC-59707RBU553S74CDTXSID0063153RefChem:526660DTXCID9039315223-092-6pyridin-4-ylmethanamine

Show more names

C-PYRIDIN-4-YL-METHYLAMINE4AMPYγ-Picolylaminep-PicolylamineCompound Fr140004-PICOLYLAMIN 98%

4-Pyridinemethaneamine4-Picolylamine4-Aminomethylpyridine4-Picolinylamine4-Pyridinemethylamine1-pyridin-4-ylmethanamine4-Picolinamine(pyridin-4-yl)methanamine

Database identifiers

CAS: 3731-53-1
PubChem CID: 77317
DTXSID: DTXSID0063153
ChEMBL: CHEMBL1188378
UNII: RBU553S74C
EC Number: 223-092-6
Nikkaji: J58.007D

Properties

Computed structural properties

XLogP: -0.4
Topological polar surface area: 38.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 8
Formal charge: 0
Complexity: 57.5

Experimental & physicochemical properties

LogP-0.38

Physicochemical properties

Melting point: 8 °C · −8 °C(lit.)
Boiling point: 230 °C · 230 °C(lit.)
Density: 1.065 g/mL · 1.065 g/mL at 25 °C(lit.)
vapor pressure: 10.4 Pa · 10.4Pa at 25℃
refractive index: 20 · n20/D 1.552(lit.)
Flash point: 227 °F · 227 °F
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
solubility: Chloroform, Ethyl Acetate
form: Oil
pka: 7.81 · 7.81±0.29(Predicted)
color: Clear Pale Yellow to Light Brown
Water Solubility: 1000 g/L · 1000g/L at 20℃
Sensitive: Air Sensitive
BRN: 108057 · 108057
InChI: 1S/C6H8N2/c7-5-6-1-3-8-4-2-6/h1-4H,5,7H2
InChIKey: TXQWFIVRZNOPCK-UHFFFAOYSA-N
SMILES: NCc1ccncc1
LogP: -0.38 · -0.38
CAS DataBase Reference: 3731 · 3731-53-1(CAS DataBase Reference)
NIST Chemistry Reference: 4 · 4-(Aminomethyl)pyridine(3731-53-1)
EPA Substance Registry System: 4 · 4-Pyridinemethanamine (3731-53-1)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 280 · P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
PPE: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
Hazard Codes: C,Xi
Risk Statements: 34 · 34-37-36/37/38
Safety Statements: 26 · 26-36/37/39-45-36
RIDADR: 2735 · UN 2735 8/PG 2
WGK Germany: 3 · 3
TSCA: TSCA listed
HazardClass: 8 · 8
PackingGroup: III
HS Code: 29333999 · 29333999
Storage Class: 8 A · 8A - Combustible corrosive hazardous materials
Hazard Classifications: 1 B · Skin Corr. 1B
REACH Registrations: Active
Limited Quantities: 1 L · 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 51 reports by companies from 5 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory InformationStatus: Active Update: 19-02-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/22369

Hazard Classes and CategoriesSkin Corr. 1B (100%)

Safety data

PPE: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
wgk: 3
tsca: TSCA listed
ridadr: UN 2735 8/PG 2
hs_code: 29333999
risk_code: 34-37-36/37/38
Signal word: Danger
Symbol(GHS): GHS05
hazard_code: C,Xi
safety_code: 26-36/37/39-45-36
hazard_class: 8
Storage Class: 8A - Combustible corrosive hazardous materials
packing_group: III
Hazard statements: H314
Limited Quantities: 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
REACH Registrations: Active
Hazard Classifications: Skin Corr. 1B
Precautionary statements: P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405

Chemistry & industry

Uses & manufacturing

General Manufacturing Information4-Pyridinemethanamine: ACTIVE

Applications

Uses4-(Aminomethyl)pyridine is a compound that has derivatives that act as reversible inhibitors of various copper amine oxidases (CAOs).

Upstream & downstream products

Upstream raw materials

Downstream products

4-Pyridylcarbinol ABC294640 4-Pyridinealdoxime 4-(Boc-aminomethyl)pyridine 1,4-bis(pyridin-4-ylmethyl)piperazine 4-[(2,5-dimethylpyrrol-1-yl)methyl]pyridine 4-pmpmd

Suppliers100 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

Syntechem Co.,Ltd[email protected]

Related reactions

354 records

New reaction record

HRID 602As reactant750 AstraZeneca ELN dataset

HRID 603As reactant750 AstraZeneca ELN dataset

HRID 12244As reactantuspto-grants-2010_06

HRID 21041As reactantuspto-grants-2010_06

HRID 37355As reactantuspto-grants-1995_05

HRID 37356As reactantuspto-grants-1995_05

HRID 49887As reactantuspto-grants-2004_03

HRID 57262As reactantuspto-grants-2016_09

Compound notes

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Basic information