Phenmethylammonium Bromide - ≥99.5%(4 Times Purification) , CAS No.37488-40-7

CAS: 37488-40-7 Cat. No.: P493016 분자식: C₇H₉N·HBr 분자량: 188.07 EC 번호: 811-786-7

GRADE & PURITY ≥99.5%(4 Times Purification)

Synonyms

benzylamine hydrobromide|37488-40-7|benzylammonium bromide|phenylmethanamine hydrobromide|phenylmethanamine;hydrobromide|benzylaminehydrobromide|BENZYLAMINE HBR|SCHEMBL1626988|Benzylammonium bromide, >=98%|DTXSID80514635|QJFMCHRSDOLMHA-UHFFFAOYSA-N|Benzyl

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

동의어

benzylamine hydrobromide | 37488-40-7 | benzylammonium bromide | phenylmethanamine hydrobromide | phenylmethanamine;hydrobromide | benzylaminehydrobromide | BENZYLAMINE HBR | SCHEMBL1626988 | Benzylammonium bromide, >=98% | DTXSID80514635 | QJFMCHRSDOLMHA-UHFFFAOYSA-N | Benzyl

사양 및 순도

≥99.5%(4 Times Purification)

보관 조건

Protected from light,Room temperature,Argon charged

배송

Normal

순수함

≥99.5%(4 Times Purification)

이름과 식별자

• Pubchem Sid: 504767302
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504767302
• 정식 스마일: C1=CC=C(C=C1)CN.Br
• IUPAC Name: phenylmethanamine;hydrobromide
• InChIKey: QJFMCHRSDOLMHA-UHFFFAOYSA-N
• INCHI: 1S/C7H9N.BrH/c8-6-7-4-2-1-3-5-7;/h1-5H,6,8H2;1H
• 이성체 SMILES: C1=CC=C(C=C1)CN.Br
• 분자량: 188.07
• Reaxy-Rn: 3911149
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3911149&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives
      • Subclass Phenylmethylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Phenylmethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylmethylamines
• Alternative Parents: Benzylamines Aralkylamines Monoalkylamines Hydrocarbon derivatives Hydrobromides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylmethylamine - Benzylamine - Aralkylamine - Organic nitrogen compound - Hydrocarbon derivative - Hydrobromide - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

화학 및 물리적 특성

• 용해성: High soluble in EtOH, DMF, DMSO, water et al
• 감도: Moisture sensitive；air sensitive；light sensitive
• 녹는점(°C): 204°C(lit.)
• 분자량: 188.060 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 187 Da
• Monoisotopic Mass: 187 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 55.400
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

참고 문헌

1. Guojun Zhou, Yan Xu, Zhiguo Xia.  (2020)  Perovskite Multiple Quantum Wells on Layered Materials toward Narrow-Band Green Emission for Backlight Display Applications.  ACS Applied Materials & Interfaces,      [PMID:32436377] [10.1021/acsami.0c07718]