5-아미노-2-메틸-2H-테트라졸

2-methyl-2H-1,2,3,4-tetrazol-5-amine

HCID 138677CAS 6154-04-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Cn1nnc(N)n1
InChIKey: AZUKLCJYWVMPML-UHFFFAOYSA-N
분자식: C2H5N5
평균 분자량: 99.1 g/mol
단동위원소 질량: 99.05449516

이름 및 식별자

우선 이름: 2-methyl-2H-1,2,3,4-tetrazol-5-amine
IUPAC: 2-methyltetrazol-5-amine
현지명: 5-아미노-2-메틸-2H-테트라졸
영어명: 5-Amino-2-methyl-2H-tetrazole
분자식: C2H5N5
분자량: 99.09

이름 및 동의어

2-methyl-2h-1,2,3,4-tetrazol-5-amineRefChem:475241612-169-35-Amino-2-methyl-2H-tetrazole6154-04-72-methyl-2H-tetrazol-5-amine2-methyltetrazol-5-amine5-Amino-2-methyltetrazole2H-Tetrazol-5-amine, 2-methyl-2-Methyl-5-aminotetrazoleMFCD018198312H-Tetrazole, 5-amino-2-methyl-

이름 더 보기

5-아미노-2-메틸-2H-테트라졸2-METHYL-2H-TETRAZOLE-5-AMINO1553840TIMTEC-BB SBB001742RARECHEM AQ NN 04632-methyl-5-aminotrazoltetrazole,5-amino-2-methyl-

69YEK2LM2MNSC-1410152-Methyl-5-Amino-2H-Tetrazole2-Methyl-5-Amino-1h-Tetrazole2-methyl-1,2,3,4-tetraazole-5-ylamine2-Methyl-5-tetrazolamine2-Methyl-2H-tetrazol-5-ylamineNSC141015

데이터베이스 식별자

CAS: 6154-04-7
PubChem CID: 138677
DTXSID: DTXSID60210527
UNII: 69YEK2LM2M
EC Number: 612-169-3
Nikkaji: J589.361E、J589.374G

물성

구조 계산 물성

XLogP: -0.2
극성 표면적: 69.6 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 4
회전 가능 결합 수: 0
무거운 원자 수: 7
형식 전하: 0
복잡도: 63.1

실험 및 물리화학적 성질

SpringerMaterials PropertiesBoiling point

물리화학적 성질

녹는점: 104.5 · 104.5-105.5 °C
끓는 점: 282.9 · 282.9±23.0 °C(Predicted)
밀도: 1.75 · 1.75±0.1 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
산도 계수 (pKa): 2.43 · 2.43±0.10(Predicted)
InChI: InChI=1S/C2H5N5/c1-7-5-2(3)4-6-7/h1H3,(H2,3,5)
InChIKey: AZUKLCJYWVMPML-UHFFFAOYSA-N
SMILES: N1=C(N)N=NN1C
NIST: 5 · 5-Amino-2-methyl-2H-tetrazole(6154-04-7)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H228 (50%): Flammable solid [Danger Flammable solids]

P210, P240, P241, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, 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.