N,N,N',N'-테트라메틸벤젠-1,3-디아민

1,3-Benzenediamine, N1,N1,N3,N3-tetramethyl-

HCID 89715CAS 22440-93-3

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CN(C)c1cccc(N(C)C)c1
InChIKey: LFZLVJBOEONQHV-UHFFFAOYSA-N
분자식: C10H16N2
평균 분자량: 164.25 g/mol
단동위원소 질량: 164.13134851

이름 및 식별자

우선 이름: 1,3-Benzenediamine, N1,N1,N3,N3-tetramethyl-
IUPAC: 1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine
현지명: N,N,N',N'-테트라메틸벤젠-1,3-디아민
영어명: N,N,N',N'-tetramethylbenzene-1,3-diamine
분자식: C10H16N2
분자량: 164.25

이름 및 동의어

N,N,N',N'-Tetramethylbenzene-1,3-diamineN,N,N',N'-Tetramethyl-m-phenylenediamineEINECS 244-998-81,3-Benzenediamine, N1,N1,N3,N3-tetramethyl-RefChem:412872244-998-822440-93-31,3-Bis(dimethylamino)benzene1,3-Benzenediamine, N,N,N',N'-tetramethyl-N1,N1,N3,N3-tetramethylbenzene-1,3-diamineMFCD237044021-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine

이름 더 보기

N,N,N',N'-테트라메틸벤젠-1,3-디아민1,3-Bis(dimethyL1,3-Di(dimethylamino)benzene(1,3-Phenylene)bis(dimethylamine)1,3-BIS(DIMETHYLAMINO)BENZENE,98%N,N,N'N'-tetraMethyl-1,3-benzenediaMMine

N1,N1,N3,N3-Tetramethyl-1,3-benzenediamine1,3-bis[dimethylamino]benzolSCHEMBL297356SCHEMBL2242134SCHEMBL2777570SCHEMBL4391221CHEMBL3822693DTXSID0066799

데이터베이스 식별자

CAS: 22440-93-3
PubChem CID: 89715
DTXSID: DTXSID0066799
ChEMBL: CHEMBL3822693
EC Number: 244-998-8
Nikkaji: J253.678A

물성

구조 계산 물성

XLogP: 2
극성 표면적: 6.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 12
형식 전하: 0
복잡도: 118

물리화학적 성질

끓는 점: 140 °C · 140 °C(Press: 15 Torr)
밀도: 0.976 g/mLat · 0.976g/mLat 25℃
굴절률: 20 · n20/D 1.580
인화점: 110 °C · >110°C
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
산도 계수 (pKa): 5.15 · 5.15±0.10(Predicted)
물리적 상태: 액체
색상: 무색의
InChI: 1S/C10H16N2/c1-11(2)9-6-5-7-10(8-9)12(3)4/h5-8H,1-4H3
InChIKey: LFZLVJBOEONQHV-UHFFFAOYSA-N
SMILES: CN(C)c1cccc(c1)N(C)C
EPA: 1 · 1,3-Benzenediamine, N,N,N',N'-tetramethyl- (22440-93-3)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P272, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 3 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 2811 6.1 / PGIII
risk_code: 25-36/37/38-43-52
hazard_code: T
safety_code: 26-36/37-45
Hazard Classifications: Acute Tox. 3 OralEye Irrit. 2Skin Irrit. 2Skin Sens. 1STOT SE 3
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects